data_6ujv_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 6ujv _Structure_validation_residue.Date_analyzed 2020-05-08 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 . . . . . . . . . . . . . 1.4 mt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 69.0 mt 57.97 116.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.981 0.896 . . . . 0.0 112.117 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -176.63 175.04 1.76 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.532 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.67 -39.87 52.17 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.504 0.668 . . . . 0.0 110.837 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -74.37 -36.07 63.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.51 0.671 . . . . 0.0 111.7 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -43.21 78.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 111.301 -179.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -67.16 -46.27 74.5 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.498 0.666 . . . . 0.0 110.242 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.59 -38.0 83.4 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.469 0.652 . . . . 0.0 110.758 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.8 m -60.41 -33.82 73.05 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.347 0.594 . . . . 0.0 111.115 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.0 tp -61.28 -25.52 67.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.87 0.367 . . . . 0.0 111.605 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -59.84 -25.87 65.35 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.766 -0.584 . . . . 0.0 110.799 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -64.12 -27.28 68.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.204 0.526 . . . . 0.0 111.15 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -59.68 -52.51 65.2 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.766 0.793 . . . . 0.0 110.215 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 26.1 t80 64.12 24.72 13.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.116 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -143.5 -61.93 0.4 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.67 -0.644 . . . . 0.0 111.338 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.7 tp -67.58 -37.68 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.395 0.617 . . . . 0.0 110.574 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -52.95 -34.24 54.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -67.33 -50.14 61.23 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.218 0.533 . . . . 0.0 111.31 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -43.35 87.0 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.425 0.631 . . . . 0.0 109.823 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.37 -35.91 81.53 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -99.58 8.37 44.5 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -176.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -120.24 -10.89 9.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.514 -0.742 . . . . 0.0 112.088 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 6.8 pt -61.6 -35.73 68.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 121.867 -0.521 . . . . 0.0 110.527 178.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -47.29 68.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.036 -0.415 . . . . 0.0 110.765 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -68.86 -35.96 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.96 -28.12 67.39 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.427 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 18.2 mm -60.79 -46.14 96.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.284 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 62.6 mt -64.67 -38.48 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.2 -37.19 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 95.3 t -54.55 -40.4 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.66 -39.37 85.94 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 177.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.3 m -66.66 -38.36 86.7 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.722 0.772 . . . . 0.0 109.413 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.39 -46.31 89.03 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.72 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . 0.402 HG23 HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -67.99 -40.56 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.439 -179.561 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.47 -24.2 61.37 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -38.2 82.76 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.88 0.848 . . . . 0.0 109.632 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -55.5 -28.17 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.486 0.715 . . . . 0.0 112.243 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.15 -39.42 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -177.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.63 -30.49 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 O-C-N 121.609 -0.682 . . . . 0.0 109.704 176.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.95 -29.06 59.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.92 0.39 . . . . 0.0 110.445 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.04 71.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.6 m -59.56 -35.85 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.025 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.73 -39.45 77.33 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 58.1 m -62.72 -38.29 89.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.581 0.705 . . . . 0.0 109.794 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -45.72 93.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.31 1.052 . . . . 0.0 108.571 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.35 -45.27 99.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.12 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 3.2 m120 -62.68 -38.45 90.44 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.244 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -62.61 -45.94 90.57 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.805 -0.559 . . . . 0.0 111.0 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.19 -42.01 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-O 122.233 1.016 . . . . 0.0 109.033 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -70.56 -18.93 62.92 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 27.5 tt0 -86.72 -13.47 45.25 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.499 0.666 . . . . 0.0 111.876 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 97.09 46.61 2.38 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.1 t80 52.18 -127.73 2.41 Favored 'General case' 0 CA--C 1.564 1.5 0 O-C-N 122.0 -0.706 . . . . 0.0 109.8 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 66.2 m -62.25 130.9 93.41 Favored Pre-proline 0 C--N 1.347 0.49 0 O-C-N 120.987 -1.071 . . . . 0.0 109.378 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -43.59 106.62 0.08 OUTLIER 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 121.111 1.207 . . . . 0.0 111.922 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -99.61 -5.4 29.09 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 122.507 1.146 . . . . 0.0 109.18 -178.699 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 121.872 0.844 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -57.74 -26.09 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.634 0.73 . . . . 0.0 110.739 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.8 -22.78 26.34 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 5.8 mtm105 -65.63 -46.62 78.56 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.663 -0.648 . . . . 0.0 112.472 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -44.62 91.52 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.75 -0.594 . . . . 0.0 110.827 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -40.15 72.48 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.125 -0.36 . . . . 0.0 111.331 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 61.9 p -65.5 -33.46 75.98 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 122.203 -0.311 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.17 -46.45 95.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.28 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.481 ' CD ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -62.09 -8.71 5.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.171 -1.412 . . . . 0.0 111.313 -177.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.73 -14.94 2.55 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.427 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.316 1.9 t -52.97 -54.59 16.06 Favored 'Isoleucine or valine' 0 C--N 1.35 0.595 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 176.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.36 -28.58 62.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.06 -1.427 . . . . 0.0 109.103 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.78 -19.9 30.57 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.035 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 78.6 p -57.93 -37.74 74.64 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 36.8 tp -62.1 -50.87 70.2 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.16 72.4 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.629 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.97 -44.05 91.48 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.62 -0.675 . . . . 0.0 110.768 -178.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.8 mt -61.56 -36.97 76.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.62 68.84 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.228 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.551 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 51.5 m-20 -55.58 -43.85 76.36 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.383 0.611 . . . . 0.0 109.805 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.46 -41.08 73.26 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 110.682 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.65 -33.54 76.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.711 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -77.42 -30.84 53.66 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 6.5 p -77.33 -45.25 26.73 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.359 -0.838 . . . . 0.0 110.342 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -53.72 23.3 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -178.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 92.0 p -98.13 -49.15 4.84 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.538 -0.726 . . . . 0.0 112.69 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 17.4 tp 101.29 -87.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.318 1.447 . . . . 0.0 110.689 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -110.8 -70.68 0.8 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.468 -0.77 . . . . 0.0 110.976 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.4 t -87.25 158.74 19.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.201 0.524 . . . . 0.0 110.322 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -83.11 13.26 4.23 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.037 0.446 . . . . 0.0 111.529 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -98.93 -41.73 7.46 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.622 0.725 . . . . 0.0 109.321 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -56.04 -29.91 61.13 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.753 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -31.02 69.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.051 -0.406 . . . . 0.0 111.244 -177.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ptt85 -57.49 -40.18 78.07 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.612 0.72 . . . . 0.0 109.637 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.39 -42.98 74.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.048 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.428 ' O ' HD12 ' A' ' 777' ' ' ILE . 5.3 tt -60.57 -38.42 84.5 Favored 'General case' 0 C--N 1.349 0.56 0 CA-C-O 121.438 0.637 . . . . 0.0 110.459 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -35.76 72.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.146 0.974 . . . . 0.0 109.328 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.95 -44.95 65.01 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.399 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . 0.428 HD12 ' O ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -65.82 -37.3 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.91 -0.494 . . . . 0.0 111.056 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 17.4 m -60.81 -46.54 96.0 Favored 'Isoleucine or valine' 0 C--N 1.35 0.588 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.271 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 7.2 m -64.22 -36.91 85.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-O 121.824 0.821 . . . . 0.0 109.674 177.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -65.58 -30.35 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.944 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . 0.401 HG23 ' N ' ' A' ' 782' ' ' VAL . 3.5 tp -53.49 -36.57 27.92 Favored 'Isoleucine or valine' 0 C--N 1.348 0.529 0 O-C-N 121.887 -0.508 . . . . 0.0 111.28 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.401 ' N ' HG23 ' A' ' 781' ' ' ILE . 16.7 m -55.09 -38.11 45.19 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 C-N-CA 119.354 -0.939 . . . . 0.0 110.271 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -64.91 -46.58 81.11 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.509 0.671 . . . . 0.0 110.756 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.47 -40.9 96.56 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.527 0.679 . . . . 0.0 111.39 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 59.4 tp . . . . . 0 CA--C 1.548 0.876 0 CA-C-O 121.102 0.477 . . . . 0.0 111.746 -179.235 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 60.92 116.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.313 0.577 . . . . 0.0 110.506 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -173.72 161.98 3.98 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.347 0.594 . . . . 0.0 109.64 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -55.41 -43.99 75.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.656 0.741 . . . . 0.0 110.31 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.18 -28.62 67.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.376 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.0 tptt -75.57 -48.9 20.36 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.045 0.45 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -58.55 -45.99 87.77 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.616 0.722 . . . . 0.0 110.39 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.22 66.66 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.681 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 27.6 t -72.32 -26.82 62.09 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.987 0.422 . . . . 0.0 111.545 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.37 -39.16 92.26 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.964 -0.46 . . . . 0.0 111.602 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -59.73 -20.36 56.0 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.931 -0.481 . . . . 0.0 111.355 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -82.07 -24.43 35.26 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.292 0.568 . . . . 0.0 111.006 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -68.9 -47.27 66.22 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.511 0.672 . . . . 0.0 110.626 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 44.2 t80 58.28 32.17 21.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.68 0.752 . . . . 0.0 111.31 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -140.26 -70.83 0.38 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.815 -0.553 . . . . 0.0 110.662 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.15 -37.5 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 121.848 -0.532 . . . . 0.0 111.081 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -52.56 -35.46 53.81 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 24.7 m120 -62.83 -50.08 72.36 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.493 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -66.24 -43.77 85.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.982 0.896 . . . . 0.0 109.638 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.66 -35.72 78.75 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.127 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -94.79 -50.83 4.97 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -53.33 -18.2 2.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 1.9 pp -60.51 -36.65 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.759 -0.588 . . . . 0.0 110.544 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 14.1 ttt-85 -58.25 -47.46 83.49 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.908 -0.495 . . . . 0.0 110.93 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -68.04 -34.48 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -27.94 69.2 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.253 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 18.5 mm -60.7 -50.87 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.417 0.627 . . . . 0.0 110.213 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.68 -40.4 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.27 0.557 . . . . 0.0 109.524 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.52 -38.9 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.85 -48.12 90.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.51 -27.0 10.89 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.769 -0.582 . . . . 0.0 111.744 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 5.4 m -60.81 -45.27 95.09 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.401 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.26 -32.39 69.96 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.651 -0.656 . . . . 0.0 112.546 -176.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.401 ' H ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.88 -46.36 87.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 O-C-N 121.725 -0.609 . . . . 0.0 110.165 -178.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.98 -31.73 79.61 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.66 -36.55 72.04 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.493 1.139 . . . . 0.0 110.389 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -55.59 -28.88 57.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -177.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -36.68 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.907 -1.121 . . . . 0.0 110.251 -176.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.36 -30.85 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.444 -0.785 . . . . 0.0 110.92 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -56.71 -31.42 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.857 -0.527 . . . . 0.0 110.404 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.4 80.37 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.51 -38.06 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.96 -37.68 88.47 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.157 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 59.6 p -64.06 -34.55 78.27 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.212 0.53 . . . . 0.0 110.743 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -43.12 94.73 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.129 0.966 . . . . 0.0 109.161 178.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.98 -44.92 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.15 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.54 -36.15 81.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -62.04 -50.03 73.63 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 122.071 0.939 . . . . 0.0 109.999 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.7 t -77.57 -44.07 29.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.921 -1.036 . . . . 0.0 113.239 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -57.79 -44.24 86.13 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 6.6 pt20 -103.79 -23.76 13.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.58 128.51 3.0 Favored Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -71.19 -60.55 2.17 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.75 152.28 90.59 Favored Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 121.152 -0.967 . . . . 0.0 110.58 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -32.72 113.49 0.06 OUTLIER 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.563 2.176 . . . . 0.0 112.501 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.3 -16.33 59.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 122.097 0.951 . . . . 0.0 112.126 -178.976 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 121.002 0.43 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -28.15 63.16 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.081 0.467 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.16 -7.12 3.66 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . 0.412 ' O ' HG13 ' B' ' 746' ' ' ILE . 8.2 ttp-105 -68.19 -40.25 82.28 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.806 -0.559 . . . . 0.0 111.623 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.11 -43.68 87.31 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.243 0.544 . . . . 0.0 109.715 -179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -39.33 71.45 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.188 178.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.6 p -56.94 -34.41 67.97 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 121.326 -0.858 . . . . 0.0 110.957 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 742' ' ' ARG . 87.1 mt -52.88 -25.2 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.478 -0.773 . . . . 0.0 112.287 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -28.48 67.31 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.783 1.629 . . . . 0.0 109.132 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 3.5 mt -55.9 -16.36 4.56 Favored 'General case' 0 C--N 1.353 0.741 0 O-C-N 121.75 -0.594 . . . . 0.0 110.696 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 31.8 t -56.54 -54.13 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 106.978 -1.489 . . . . 0.0 106.978 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -72.68 -16.37 61.69 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.473 175.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.19 -20.58 36.21 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.716 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 14.4 m -58.72 -37.93 77.2 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.999 0.9 . . . . 0.0 109.882 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.78 -51.05 37.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.483 0.658 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.92 76.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.232 0.539 . . . . 0.0 111.67 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.5 tt -59.12 -45.36 91.13 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.907 -0.496 . . . . 0.0 110.734 -177.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.4 mt -66.08 -36.27 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 122.135 0.969 . . . . 0.0 108.844 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.12 -29.53 69.3 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.834 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -54.94 -48.21 73.45 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.586 -0.697 . . . . 0.0 109.466 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.92 -45.48 64.19 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.14 -46.43 74.09 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -64.9 -29.74 70.7 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.819 -0.55 . . . . 0.0 112.372 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 80.0 p -75.71 -45.47 36.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.543 0.687 . . . . 0.0 110.95 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 2.0 mp -61.07 -54.77 40.64 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 13.7 p -98.71 -49.62 4.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.528 0.68 . . . . 0.0 112.678 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 12.8 tp 71.1 99.66 0.06 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.718 0.77 . . . . 0.0 110.47 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.89 -80.94 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.207 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 17.6 p -84.31 158.32 21.22 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.638 -0.664 . . . . 0.0 110.558 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -89.52 -31.76 17.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.96 0.409 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.26 -37.71 64.99 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.999 0.904 . . . . 0.0 109.199 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -56.22 -29.77 61.41 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.546 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.65 -41.0 89.54 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.905 -0.497 . . . . 0.0 109.698 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -57.74 -42.91 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.94 -46.17 90.5 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -37.77 78.41 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.741 0.782 . . . . 0.0 109.997 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.07 -36.91 73.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.074 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 49.5 mt -70.71 -48.34 55.09 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.585 -0.697 . . . . 0.0 111.364 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 18.4 pt -62.58 -36.12 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.899 0.38 . . . . 0.0 109.98 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -54.81 -45.79 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -36.03 82.56 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.641 0.734 . . . . 0.0 110.492 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -67.08 -37.88 84.75 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 64.1 mt -63.92 -41.59 93.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.999 -0.438 . . . . 0.0 111.266 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.8 m -58.14 -38.58 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 121.282 -0.886 . . . . 0.0 110.176 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -59.97 -42.08 93.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.725 0.774 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.59 -43.36 85.1 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.605 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 5.9 tp -82.36 -18.31 42.56 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 122.05 -0.406 . . . . 0.0 111.604 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -50.76 -42.94 46.76 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 118.89 36.62 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.759 -179.414 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 8.3 mp 59.02 109.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.712 0.768 . . . . 0.0 110.807 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -173.11 165.74 4.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.488 0.661 . . . . 0.0 110.243 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.7 -55.74 15.14 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.486 0.66 . . . . 0.0 110.591 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -71.03 -19.66 62.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.538 . . . . 0.0 112.384 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -80.61 -44.71 18.48 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.074 -0.391 . . . . 0.0 111.187 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -64.64 -45.76 85.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.407 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.24 -19.3 65.78 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.936 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 15.7 p -72.17 -28.63 63.35 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.815 -0.553 . . . . 0.0 111.327 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.33 -38.66 87.7 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 122.106 -0.372 . . . . 0.0 111.621 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -59.58 -29.79 68.2 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.599 -0.688 . . . . 0.0 110.985 -178.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -63.94 -31.99 73.36 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.472 0.653 . . . . 0.0 110.624 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -63.31 -41.65 98.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.495 0.664 . . . . 0.0 110.371 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 52.18 36.75 20.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.542 0.687 . . . . 0.0 111.334 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -146.59 -72.0 0.23 Allowed 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.604 -0.685 . . . . 0.0 111.338 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -67.78 -37.5 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.952 -0.468 . . . . 0.0 110.981 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -52.24 -34.69 47.16 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -66.06 -50.15 65.17 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.712 -0.618 . . . . 0.0 110.451 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.81 -43.85 87.4 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 121.617 0.722 . . . . 0.0 109.727 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.05 -35.89 82.22 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -178.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.98 -8.0 22.81 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -97.81 -11.66 23.06 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.378 -0.826 . . . . 0.0 112.927 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.3 pp -60.91 -36.6 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 O-C-N 121.744 -0.597 . . . . 0.0 110.499 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 ttt-85 -54.09 -47.42 71.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.776 0.322 . . . . 0.0 111.1 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -68.81 -35.95 71.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.79 -32.37 70.55 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.92 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 7.8 mm -60.61 -44.34 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.35 -41.62 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.88 -37.69 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 94.0 t -54.95 -39.8 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.22 -42.52 82.44 Favored Glycine 0 C--N 1.346 1.137 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.4 -38.7 90.74 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.991 0.9 . . . . 0.0 109.021 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 tp -59.87 -43.99 94.42 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.083 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.2 pp -65.63 -41.86 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.979 -0.45 . . . . 0.0 109.91 -178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.25 -27.74 71.99 Favored Glycine 0 CA--C 1.537 1.429 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 178.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.6 tt -60.86 -39.46 89.25 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.877 0.846 . . . . 0.0 110.113 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.25 -29.17 60.72 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . 0.431 HG21 HD12 ' C' ' 697' ' ' ILE . 0.1 OUTLIER -59.26 -36.21 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -176.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.38 -30.6 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.317 -0.864 . . . . 0.0 110.631 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -56.45 -31.32 63.86 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.999 -0.438 . . . . 0.0 110.281 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.72 79.0 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 177.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -43.44 92.8 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 122.07 0.938 . . . . 0.0 108.565 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.9 -37.67 87.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.403 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.3 m -62.76 -39.17 93.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.196 0.522 . . . . 0.0 110.343 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.12 -44.98 95.46 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.62 -45.16 99.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.85 0.833 . . . . 0.0 108.892 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -62.6 -37.0 84.54 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.373 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.31 -49.78 71.29 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -36.02 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.36 0.6 . . . . 0.0 111.95 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -70.36 -44.25 68.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.04 -21.49 13.92 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.01 178.54 17.8 Favored Glycine 0 CA--C 1.537 1.448 0 N-CA-C 110.194 -1.162 . . . . 0.0 110.194 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -132.9 -54.42 0.93 Allowed 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.896 -0.767 . . . . 0.0 112.328 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 1.7 m -71.66 142.0 85.62 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-O 118.776 -0.63 . . . . 0.0 109.309 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -30.06 96.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 123.101 2.534 . . . . 0.0 113.195 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.48 18.5 2.25 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.492 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.838 0.827 . . . . 0.0 109.647 -179.115 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.997 0.904 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -69.19 -26.47 64.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.143 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -64.71 -36.99 86.08 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -74.34 -38.57 63.22 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.27 -37.47 75.05 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.941 -1.099 . . . . 0.0 109.337 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -71.43 -37.04 71.48 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.885 0.374 . . . . 0.0 110.475 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 18.9 p -67.94 -35.28 78.15 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.831 -0.543 . . . . 0.0 111.243 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.5 -22.2 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -59.47 -30.05 68.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -16.35 48.58 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.539 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 44.5 t -55.53 -54.47 25.2 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -72.53 -24.64 61.17 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 122.223 1.011 . . . . 0.0 108.547 174.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -20.13 32.54 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.996 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 42.7 m -58.44 -40.71 83.32 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 117.546 0.673 . . . . 0.0 109.332 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 22.6 tp -62.85 -51.14 68.16 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.91 -34.4 71.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.713 0.768 . . . . 0.0 111.28 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.56 -45.25 89.35 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.489 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.73 -29.54 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.68 -31.64 69.8 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -55.43 -47.17 76.38 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.937 -1.102 . . . . 0.0 109.622 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.59 -45.27 65.67 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.32 -45.98 78.47 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -66.61 -49.64 65.66 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 23.0 p -67.51 -40.89 85.14 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.68 -0.637 . . . . 0.0 111.042 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -54.47 15.97 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.75 -49.37 4.85 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.304 -0.873 . . . . 0.0 112.331 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 6.5 tp 78.17 83.62 0.07 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 122.088 0.947 . . . . 0.0 111.042 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.17 -81.01 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.389 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 16.8 p -86.5 165.97 15.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.529 -0.732 . . . . 0.0 111.683 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -28.52 29.46 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -52.88 -37.16 60.14 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.964 0.888 . . . . 0.0 108.932 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 71.4 mmt-85 -69.31 -30.9 69.06 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.628 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 8.6 tt -60.97 -35.35 76.56 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.738 -0.601 . . . . 0.0 109.961 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -57.34 -35.18 69.58 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -63.06 -42.08 99.6 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . 0.401 ' O ' HD13 ' C' ' 774' ' ' LEU . 0.2 OUTLIER -63.25 -38.52 91.47 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-O 122.057 0.932 . . . . 0.0 109.104 177.868 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.11 -43.18 87.02 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.737 -0.602 . . . . 0.0 110.036 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.13 -35.58 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.337 0.589 . . . . 0.0 110.737 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 2.7 tt -65.17 -37.59 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.158 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.39 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.323 -0.861 . . . . 0.0 110.642 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.6 m -64.42 -48.72 74.28 Favored 'General case' 0 C--N 1.344 0.331 0 O-C-N 121.833 -0.542 . . . . 0.0 112.085 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -31.56 71.74 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.389 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 19.6 mt -54.96 -36.15 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 122.215 -0.303 . . . . 0.0 110.649 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.481 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 23.0 m -52.87 -38.09 27.48 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 O-C-N 121.256 -0.902 . . . . 0.0 110.944 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.333 0.587 . . . . 0.0 111.188 178.8 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.689 0.757 . . . . 0.0 109.128 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 33.4 mt 59.52 106.75 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.978 0.894 . . . . 0.0 110.797 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 179.41 -178.62 0.37 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.18 -46.04 86.46 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 121.363 -0.836 . . . . 0.0 109.696 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.9 -33.02 73.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.463 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 -49.05 11.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 111.007 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -64.8 -40.72 95.7 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 110.685 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.12 62.58 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.703 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -29.98 64.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.17 0.51 . . . . 0.0 111.001 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.78 -36.78 77.38 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.057 -0.402 . . . . 0.0 110.898 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -59.71 -17.4 34.33 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.884 0.373 . . . . 0.0 111.384 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.68 -29.02 21.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.334 0.588 . . . . 0.0 110.661 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -59.9 -48.97 79.51 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.681 0.753 . . . . 0.0 110.576 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 60.25 40.03 18.39 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.892 0.853 . . . . 0.0 110.58 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -71.06 0.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.923 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.9 tp -68.25 -37.51 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 121.957 -0.464 . . . . 0.0 111.326 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.15 -35.73 49.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -64.71 -50.14 68.14 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.376 0.608 . . . . 0.0 110.568 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -65.53 -43.05 91.21 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.675 0.75 . . . . 0.0 109.997 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -35.62 81.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -102.82 -3.15 26.76 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -109.37 -5.61 15.77 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.346 0.975 . . . . 0.0 112.729 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.7 pt -68.48 -36.13 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 110.779 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -53.26 -41.73 65.79 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.254 0.549 . . . . 0.0 110.047 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -76.8 -34.96 23.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 177.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.84 -38.93 83.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.169 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.6 -45.58 97.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 86.3 mt -61.73 -39.55 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.85 -37.73 73.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.982 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.85 -40.04 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.49 83.48 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 16.4 m -62.14 -38.68 89.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.04 0.924 . . . . 0.0 109.606 177.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.29 -39.33 86.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.923 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -43.17 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-O 121.153 0.501 . . . . 0.0 110.39 -178.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.12 92.96 Favored Glycine 0 CA--C 1.535 1.321 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.1 tt -53.5 -38.7 63.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 122.278 1.037 . . . . 0.0 110.045 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -57.02 -28.82 62.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.091 0.956 . . . . 0.0 112.362 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 40.7 mt -59.51 -36.54 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 O-C-N 121.502 -0.749 . . . . 0.0 110.438 -176.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 2.5 p -66.49 -30.51 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.468 -0.77 . . . . 0.0 110.763 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -55.59 -28.53 55.61 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.547 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.4 -36.9 71.89 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.8 m -61.17 -36.6 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.533 -0.729 . . . . 0.0 109.578 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.9 tp -57.62 -37.64 73.61 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.995 -0.44 . . . . 0.0 110.429 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 16.0 m -62.24 -40.49 96.35 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.442 0.639 . . . . 0.0 109.997 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.59 -43.17 97.68 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.4 t -64.71 -45.01 96.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 CA-C-O 121.858 0.837 . . . . 0.0 109.101 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.84 -36.2 80.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.876 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -65.71 -49.52 68.2 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.22 0.534 . . . . 0.0 111.668 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -76.32 -44.06 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.921 0.867 . . . . 0.0 110.279 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -63.37 -22.09 66.67 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -92.85 -21.77 19.68 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.181 -0.949 . . . . 0.0 112.114 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 111.79 35.42 1.86 Allowed Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 71.97 -171.93 0.15 Allowed 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.28 1.038 . . . . 0.0 111.502 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 3.7 m -62.46 161.25 27.65 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.499 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -12.51 92.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 124.56 3.507 . . . . 0.0 115.692 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.83 -17.16 14.28 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.919 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 122.292 1.044 . . . . 0.0 110.932 -178.546 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-O 121.922 0.868 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -26.1 65.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.296 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -55.79 -6.79 0.24 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.22 -41.54 88.87 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.273 -0.892 . . . . 0.0 109.757 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.04 -45.19 78.2 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.143 0.497 . . . . 0.0 110.442 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -30.86 71.32 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.275 0.559 . . . . 0.0 110.651 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 13.1 p -67.53 -46.56 72.47 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.404 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.5 mt -61.46 -47.0 95.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.803 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.616 ' NE ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.91 -7.55 11.9 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 117.844 -1.543 . . . . 0.0 111.278 -177.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -14.82 19.61 Favored 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 171.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.291 1.6 t -53.06 -55.15 13.57 Favored 'Isoleucine or valine' 0 C--N 1.356 0.884 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 177.294 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.446 ' ND2' ' NE ' ' A' ' 747' ' ' ARG . 2.3 m-80 -73.32 -27.64 61.64 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.924 174.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.81 -19.59 29.56 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 89.0 p -57.49 -37.28 72.69 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.86 -48.09 82.11 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.66 -34.88 71.73 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.011 0.434 . . . . 0.0 110.54 177.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.85 -45.07 90.95 Favored 'General case' 0 C--N 1.345 0.397 0 O-C-N 121.981 -0.449 . . . . 0.0 111.412 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.54 -33.08 55.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.16 -30.14 68.31 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.374 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.422 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.0 m-20 -55.16 -45.75 75.7 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.43 -0.794 . . . . 0.0 109.846 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.94 -44.35 69.75 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.473 0.654 . . . . 0.0 111.237 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -37.48 87.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -67.51 -44.56 78.15 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.245 0.545 . . . . 0.0 111.796 -178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.6 t -64.88 -45.18 87.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.962 0.887 . . . . 0.0 111.499 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -54.15 36.58 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -177.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 1.4 m -98.45 -22.99 15.74 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 8.9 tp 77.07 -60.53 0.46 Allowed 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.733 -0.604 . . . . 0.0 109.886 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.96 -67.72 0.29 Allowed 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.019 -0.425 . . . . 0.0 111.108 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.0 m -93.27 155.07 17.65 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.036 0.446 . . . . 0.0 110.531 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.97 -40.27 94.74 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.029 0.442 . . . . 0.0 110.323 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -53.94 -39.22 65.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.885 0.85 . . . . 0.0 109.664 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -58.47 -29.87 66.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.777 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.56 -36.1 75.54 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 109.964 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -57.14 -33.34 67.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.484 0.659 . . . . 0.0 109.524 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -62.83 -42.36 99.7 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.817 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.83 -38.36 78.5 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 121.181 0.515 . . . . 0.0 110.869 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.95 -39.83 93.44 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.158 0.504 . . . . 0.0 111.895 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 39.6 mt -75.11 -42.16 57.02 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.81 -0.556 . . . . 0.0 112.395 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 1.1 pt -68.78 -37.51 77.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.731 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 27.5 m -58.48 -42.65 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.543 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 9.9 t -63.57 -35.38 80.31 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 121.59 -0.694 . . . . 0.0 111.292 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.91 73.14 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.017 0.437 . . . . 0.0 111.692 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.23 -41.97 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.996 -0.44 . . . . 0.0 111.439 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 10.4 m -54.95 -38.82 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.741 -0.6 . . . . 0.0 110.702 -178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -59.87 -48.84 80.07 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.327 0.584 . . . . 0.0 111.086 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.18 -43.37 70.92 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.391 0 O-C-N 121.906 -0.496 . . . . 0.0 111.161 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 52.29 83.47 0.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.875 0.845 . . . . 0.0 110.539 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -150.79 157.81 43.39 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.685 0.755 . . . . 0.0 110.555 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.0 -57.69 4.75 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 122.283 1.039 . . . . 0.0 111.559 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -64.33 -28.92 70.04 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.437 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -71.62 -49.43 40.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.03 0.443 . . . . 0.0 110.401 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -61.95 -46.63 88.44 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.355 0.597 . . . . 0.0 110.518 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.36 -21.49 66.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.7 t -70.67 -32.9 70.34 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 111.038 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.46 -31.53 70.52 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.402 0.62 . . . . 0.0 111.087 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -59.61 -21.11 59.93 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.185 0.516 . . . . 0.0 111.321 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -86.8 -26.8 23.92 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.16 0.505 . . . . 0.0 111.216 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -60.13 -48.44 81.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.419 0.628 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.2 t80 59.82 40.86 18.91 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 122.027 0.917 . . . . 0.0 110.817 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.61 -72.05 0.2 Allowed 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.856 -0.528 . . . . 0.0 110.687 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -68.42 -37.22 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 O-C-N 121.961 -0.462 . . . . 0.0 111.303 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -52.36 -33.96 45.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -69.02 -50.14 51.43 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.604 -0.685 . . . . 0.0 110.875 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -65.76 -44.26 86.4 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.824 0.821 . . . . 0.0 109.126 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.17 -35.89 81.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -95.9 -21.0 18.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -95.95 -5.27 41.72 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.285 -0.885 . . . . 0.0 112.17 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.473 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 4.3 pt -62.59 -36.65 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.721 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -53.04 -47.36 68.47 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.979 0.419 . . . . 0.0 110.62 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.57 -35.33 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.473 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.34 -31.12 70.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.957 179.475 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 19.2 mm -60.8 -44.72 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 109.856 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.34 -41.07 88.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.305 0.574 . . . . 0.0 109.502 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.11 -38.79 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 54.0 t -57.63 -39.71 71.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -64.64 -26.77 71.18 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.4 m -60.62 -46.6 89.66 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.403 HD13 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.91 -33.34 71.74 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -176.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.403 ' H ' HD13 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.84 -41.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 -178.697 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.67 -34.3 88.08 Favored Glycine 0 CA--C 1.537 1.413 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.72 -37.04 77.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.224 1.012 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -55.93 -28.54 57.3 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 20.4 tt -58.63 -36.08 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 O-C-N 121.169 -0.957 . . . . 0.0 110.696 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -54.52 -30.26 21.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 O-C-N 121.859 -0.526 . . . . 0.0 110.899 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -55.98 -30.0 61.1 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.729 -0.607 . . . . 0.0 110.389 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.42 -40.81 83.49 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.35 -35.99 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tp -51.65 -37.76 51.81 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.815 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 43.0 m -62.82 -38.82 92.25 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.751 0.786 . . . . 0.0 109.948 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -43.15 99.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.429 1.109 . . . . 0.0 108.801 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 57.6 t -67.67 -40.64 84.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.695 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.4 -37.61 86.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.028 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -68.13 -44.31 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.152 0.977 . . . . 0.0 111.273 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.55 -45.35 33.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -65.88 -45.84 80.57 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 118.877 -1.129 . . . . 0.0 112.96 -175.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.422 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 0.9 OUTLIER -105.57 -24.16 12.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 -179.372 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.95 164.03 10.94 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -102.49 -61.58 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.5 p -65.55 158.81 72.01 Favored Pre-proline 0 N--CA 1.468 0.427 0 O-C-N 121.316 -0.865 . . . . 0.0 109.637 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -29.32 118.59 0.05 OUTLIER 'Trans proline' 0 N--CA 1.496 1.676 0 C-N-CA 122.784 2.323 . . . . 0.0 112.981 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 5.0 tt -83.65 -19.01 36.14 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 122.535 1.159 . . . . 0.0 111.282 -178.844 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 122.082 0.944 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 42.1 mtp85 -72.59 -25.87 61.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.254 -0.884 . . . . 0.0 113.201 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.13 -9.38 0.39 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -176.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 1.4 mtm105 -60.45 -37.62 81.54 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.406 -0.809 . . . . 0.0 110.175 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.22 -29.85 66.03 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.043 0.449 . . . . 0.0 109.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -49.39 43.44 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 121.532 0.682 . . . . 0.0 109.647 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -59.85 -33.92 72.44 Favored 'General case' 0 N--CA 1.46 0.068 0 O-C-N 122.026 -0.422 . . . . 0.0 110.214 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.07 -22.02 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 31.8 ttt-85 -59.58 -17.32 31.89 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 7.2 tt -55.03 -27.04 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 94.7 t -55.05 -53.82 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -72.66 -24.32 61.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.331 -1.304 . . . . 0.0 109.837 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.54 37.81 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.242 -178.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 24.7 m -59.43 -38.7 81.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 117.857 0.828 . . . . 0.0 109.656 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 26.0 tp -69.54 -47.13 64.71 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.49 0.662 . . . . 0.0 110.179 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.59 -35.44 77.37 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.51 -45.34 92.0 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.06 -0.4 . . . . 0.0 111.665 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.76 -36.81 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 121.377 0.608 . . . . 0.0 110.011 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.97 -30.59 69.05 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -55.91 -49.75 72.59 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.04 -1.038 . . . . 0.0 109.934 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -70.8 -42.56 70.14 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.31 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.6 -45.98 70.54 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -177.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -65.36 -20.48 66.41 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.6 m -76.6 -45.64 29.37 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.768 -0.582 . . . . 0.0 111.326 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -54.87 14.42 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 5.3 t -98.97 -49.83 4.39 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.855 0.836 . . . . 0.0 112.294 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.3 tt 63.86 89.34 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.825 0.822 . . . . 0.0 109.384 -177.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 13.1 t80 72.74 122.11 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.514 0.673 . . . . 0.0 111.222 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.0 m 57.82 164.26 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.316 0.579 . . . . 0.0 111.451 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -109.84 64.31 0.61 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.781 1.277 . . . . 0.0 110.395 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.25 -42.51 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 122.474 1.13 . . . . 0.0 108.115 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -55.94 -29.03 59.5 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.527 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.38 -31.09 68.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.247 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -43.02 99.59 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -68.99 -45.2 71.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.634 . . . . 0.0 109.807 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . 0.466 ' O ' HG13 ' B' ' 777' ' ' ILE . 0.1 OUTLIER -60.34 -37.87 81.98 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.752 0.787 . . . . 0.0 109.998 178.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -58.03 -36.8 73.24 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.673 -0.642 . . . . 0.0 110.007 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.4 mt -71.78 -38.22 70.33 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.103 -0.373 . . . . 0.0 111.884 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . 0.466 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.4 pp -69.4 -37.45 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.52 -0.738 . . . . 0.0 109.877 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 83.5 t -60.53 -46.6 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.42 -0.8 . . . . 0.0 110.012 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.6 t -63.85 -41.11 97.88 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.852 -0.53 . . . . 0.0 112.413 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.63 72.08 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.716 -0.615 . . . . 0.0 111.91 -178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.8 mt -57.88 -37.03 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 O-C-N 121.78 -0.575 . . . . 0.0 111.049 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 16.1 m -54.49 -38.14 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.301 -0.875 . . . . 0.0 110.012 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -64.33 -44.61 90.99 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.342 0.592 . . . . 0.0 110.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.08 -42.12 80.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.467 0.651 . . . . 0.0 111.253 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 8.2 tp -76.98 -20.29 56.27 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.245 0.545 . . . . 0.0 111.275 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -55.84 -28.21 52.12 Favored Glycine 0 CA--C 1.534 1.229 0 O-C-N 122.005 -0.435 . . . . 0.0 112.107 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.17 128.24 54.53 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.809 -0.818 . . . . 0.0 110.633 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.454 179.524 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.792 0.806 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.6 142.9 11.24 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -173.2 176.0 3.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.443 0.639 . . . . 0.0 110.975 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -52.94 -46.54 68.18 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 122.036 0.922 . . . . 0.0 110.943 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -64.53 -26.62 68.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.58 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -81.14 -42.38 20.99 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 110.412 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -60.71 -44.79 96.16 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.583 0.706 . . . . 0.0 110.613 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.71 -26.65 64.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.208 0.528 . . . . 0.0 111.646 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.4 t -61.33 -30.32 70.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.98 -0.45 . . . . 0.0 112.07 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.7 -39.51 88.11 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -59.8 -27.65 66.77 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.649 -0.657 . . . . 0.0 111.091 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -66.3 -32.86 74.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.292 0.567 . . . . 0.0 110.129 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -63.87 -40.93 97.7 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.792 0.806 . . . . 0.0 109.637 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.1 t80 62.16 12.24 4.93 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.978 0.732 . . . . 0.0 112.978 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -136.72 -59.94 0.71 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.566 -0.709 . . . . 0.0 112.592 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -38.23 81.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.504 0.668 . . . . 0.0 110.731 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.8 m -52.84 -38.57 61.61 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.173 0.511 . . . . 0.0 110.967 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -59.34 -49.05 79.3 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.622 0.725 . . . . 0.0 109.933 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -60.19 -43.4 95.92 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.167 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.21 -40.05 90.05 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -94.87 -10.04 32.5 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -94.6 -22.9 17.88 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.714 -0.616 . . . . 0.0 111.933 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.432 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 13.4 pt -64.51 -36.9 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.93 -0.481 . . . . 0.0 110.738 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 7.5 ttt-85 -54.47 -47.22 73.22 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.67 -34.48 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 177.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . 0.432 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.7 OUTLIER -60.34 -37.27 80.12 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.737 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 10.9 mm -61.08 -47.19 94.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.103 0.478 . . . . 0.0 109.749 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.04 -37.06 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.93 -38.87 75.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 65.4 t -58.55 -40.12 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.74 -36.29 65.17 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 12.1 m -67.31 -38.94 85.77 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.47 1.128 . . . . 0.0 110.222 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -46.49 89.16 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.425 -1.261 . . . . 0.0 114.053 -176.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -59.91 -41.58 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 O-C-N 121.82 -0.55 . . . . 0.0 110.761 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -37.06 92.33 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.97 -37.35 66.39 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.545 0.688 . . . . 0.0 109.955 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -56.71 -30.54 63.6 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.999 -0.438 . . . . 0.0 111.695 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 13.4 tt -60.98 -36.89 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.8 t -67.13 -30.7 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.635 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -62.05 -30.99 71.36 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.108 0.48 . . . . 0.0 110.115 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.75 76.43 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -63.0 -39.71 86.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -37.98 87.46 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.677 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.0 m -62.82 -37.84 88.33 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.819 -0.551 . . . . 0.0 110.285 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.96 -41.71 98.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.813 0.816 . . . . 0.0 108.807 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.72 -44.67 99.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.266 1.031 . . . . 0.0 108.475 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -60.16 -35.6 75.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.117 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -47.95 83.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.707 0.765 . . . . 0.0 110.826 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -41.28 41.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.768 0.794 . . . . 0.0 110.769 -178.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -73.19 -33.6 65.51 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.684 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -102.29 -15.77 16.49 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 103.7 -173.06 21.54 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -132.22 -53.44 0.97 Allowed 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.544 -0.974 . . . . 0.0 112.749 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 8.4 m -93.94 146.5 31.78 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-O 118.28 -0.867 . . . . 0.0 109.641 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -31.31 93.56 0.01 OUTLIER 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.623 2.215 . . . . 0.0 112.811 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . 0.439 ' O ' ' C ' ' C' ' 716' ' ' SER . 17.2 tp -73.68 -10.42 59.67 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 716' ' ' SER . . . . . 0.439 ' C ' ' O ' ' C' ' 715' ' ' LEU . 14.2 t . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 121.19 0.519 . . . . 0.0 112.29 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -26.43 62.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.51 -47.85 82.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.3 ttp85 -63.88 -36.83 85.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -58.73 -34.14 71.01 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.029 1.286 . . . . 0.0 109.268 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -71.22 -32.73 69.14 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.489 0.662 . . . . 0.0 109.655 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 5.0 p -66.5 -47.31 73.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.92 0.39 . . . . 0.0 110.078 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.0 mp -53.98 -41.07 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 O-C-N 121.404 -0.81 . . . . 0.0 110.737 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -60.99 -16.13 39.61 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 118.372 -1.331 . . . . 0.0 110.417 -178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.27 -19.26 64.41 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.362 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.0 t -55.21 -54.03 28.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.725 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -72.53 -27.12 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.816 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.67 37.46 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.53 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 97.8 p -58.69 -38.82 79.07 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.038 -0.684 . . . . 0.0 109.356 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 20.8 tp -67.07 -49.02 66.46 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.45 -35.42 74.02 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.644 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.65 -45.34 92.31 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.837 -0.539 . . . . 0.0 110.706 -178.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.35 -41.39 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.478 0.656 . . . . 0.0 109.266 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -68.4 -30.86 69.87 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.11 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -55.65 -49.48 72.77 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.347 -0.846 . . . . 0.0 110.009 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -71.12 -45.02 64.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.493 0.663 . . . . 0.0 111.049 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.44 -44.15 96.09 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -74.46 -47.5 33.11 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -177.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 79.3 p -67.34 -43.75 80.75 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.85 0.833 . . . . 0.0 111.196 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.73 -53.22 60.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.636 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 34.3 m -96.79 -13.43 22.62 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 9.0 mt 57.27 67.69 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.954 0.883 . . . . 0.0 110.717 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 59.3 t80 79.07 -89.62 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 61.8 m -93.78 171.79 8.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.305 -0.872 . . . . 0.0 111.986 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.28 -33.61 67.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.224 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -54.4 -35.08 62.49 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.019 0.914 . . . . 0.0 108.812 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.25 -30.17 64.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.798 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -60.06 -35.13 74.47 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -33.9 67.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -41.36 98.85 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 6.7 tp -59.35 -38.98 81.76 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-O 121.142 0.496 . . . . 0.0 109.717 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.91 -42.55 89.92 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.365 0.602 . . . . 0.0 110.729 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 35.8 mt -74.52 -37.21 63.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 109.668 178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . 0.585 ' O ' HG13 ' C' ' 781' ' ' ILE . 71.4 mt -61.39 -49.06 86.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.123 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 7.5 p -54.76 -39.18 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 8.3 m -63.61 -43.16 97.69 Favored 'General case' 0 C--N 1.335 -0.052 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.679 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -31.86 72.02 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.585 HG13 ' O ' ' C' ' 777' ' ' ILE . 11.5 mt -56.48 -36.27 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.838 -0.539 . . . . 0.0 110.968 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.616 ' HA ' ' NE ' ' A' ' 747' ' ' ARG . 18.0 m -52.47 -37.86 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 121.432 -0.792 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 CA--C 1.553 1.07 0 O-C-N 121.452 -0.78 . . . . 0.0 111.465 -179.924 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 120.312 0.101 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.7 mt 170.25 119.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.505 -0.747 . . . . 0.0 109.576 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.06 -174.16 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.73 -0.606 . . . . 0.0 109.881 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.34 -40.07 67.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.562 0.696 . . . . 0.0 109.855 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.8 -34.74 74.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.779 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -73.53 -44.58 57.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.44 0.638 . . . . 0.0 110.657 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -72.8 -46.26 54.17 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.185 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.97 -30.58 70.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.084 0.469 . . . . 0.0 111.658 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.0 m -65.22 -32.34 73.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.255 0.55 . . . . 0.0 111.005 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.7 -30.57 71.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.861 0.362 . . . . 0.0 111.565 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -59.45 -24.46 63.55 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.708 -0.62 . . . . 0.0 111.195 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -73.3 -22.34 60.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.085 0.469 . . . . 0.0 111.265 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.9 m95 -64.48 -45.28 88.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-O 121.154 0.502 . . . . 0.0 111.171 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . 0.427 ' O ' ' CG ' ' A' ' 673' ' ' PHE . 49.3 t80 60.67 10.03 2.43 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.394 0.616 . . . . 0.0 111.027 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -123.9 -66.94 0.96 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.988 -1.07 . . . . 0.0 111.269 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.98 -37.67 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 122.059 -0.401 . . . . 0.0 111.392 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.5 m -52.7 -38.6 60.93 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -61.79 -50.07 73.83 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 121.271 0.558 . . . . 0.0 110.433 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -65.52 -39.35 91.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.78 0.8 . . . . 0.0 109.654 178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -35.93 81.83 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -104.98 -20.01 13.66 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -84.75 -14.46 48.19 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.282 -0.886 . . . . 0.0 111.84 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . 0.44 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 7.0 pt -60.82 -35.8 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.243 0.544 . . . . 0.0 110.513 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 -53.06 -47.02 68.77 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.151 -0.343 . . . . 0.0 110.346 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.96 -32.01 56.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -62.79 -29.86 71.03 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.158 179.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 21.2 mm -60.72 -45.4 97.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.16 0.505 . . . . 0.0 110.188 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.8 mt -71.12 -37.65 67.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.138 0.494 . . . . 0.0 109.776 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.02 -37.66 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 122.053 -0.404 . . . . 0.0 110.174 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 67.4 t -54.61 -39.91 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.87 -38.77 93.0 Favored Glycine 0 CA--C 1.533 1.178 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.0 m -64.46 -38.3 90.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.815 0.817 . . . . 0.0 109.63 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -45.5 91.48 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.772 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.38 -40.96 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.721 -179.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.78 -21.62 58.64 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 177.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.53 -37.61 86.77 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.813 0.816 . . . . 0.0 109.788 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 3.0 mmt180 -55.02 -28.4 51.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -178.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.4 tt -59.2 -36.79 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 O-C-N 120.559 -1.338 . . . . 0.0 109.427 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.38 -30.92 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-O 121.514 0.673 . . . . 0.0 110.038 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.2 m-85 -55.61 -28.53 55.72 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.334 0.588 . . . . 0.0 109.733 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.0 -36.91 70.95 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.6 m -62.19 -35.72 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 O-C-N 121.59 -0.694 . . . . 0.0 109.485 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.6 -39.21 87.31 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.029 -0.419 . . . . 0.0 110.205 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -62.62 -33.82 75.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.512 0.672 . . . . 0.0 109.854 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -43.13 99.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.402 1.096 . . . . 0.0 108.745 177.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.448 ' HA ' HD21 ' A' ' 748' ' ' LEU . 67.1 t -67.77 -45.21 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.201 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.42 -37.08 84.43 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.512 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -60.19 -49.46 77.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.894 0.854 . . . . 0.0 111.005 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . 0.409 HG23 ' HA ' ' B' ' 713' ' ' SER . 0.9 OUTLIER -74.43 -43.05 49.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.001 0.905 . . . . 0.0 109.423 179.757 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.1 -14.59 61.88 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -98.41 7.68 45.87 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.011 -1.056 . . . . 0.0 113.427 -178.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 81.38 12.33 82.17 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.886 -0.509 . . . . 0.0 112.374 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER 61.94 -123.24 0.76 Allowed 'General case' 0 CA--C 1.564 1.492 0 O-C-N 121.648 -0.913 . . . . 0.0 110.774 179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 13.4 p -62.22 159.1 41.78 Favored Pre-proline 0 C--N 1.355 0.832 0 O-C-N 120.732 -1.23 . . . . 0.0 110.625 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.59 109.04 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.68 1.587 . . . . 0.0 112.836 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.22 -19.1 13.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 14.4 p . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 122.565 1.174 . . . . 0.0 110.427 -179.177 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.838 0.828 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -25.62 62.65 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.71 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.54 -13.28 0.91 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 69.3 mtm-85 -69.19 -46.68 66.86 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.458 -0.777 . . . . 0.0 109.255 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.77 -41.46 86.67 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.746 0.784 . . . . 0.0 110.267 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -35.47 76.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.444 -0.785 . . . . 0.0 111.192 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.33 -38.39 81.49 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.07 -0.394 . . . . 0.0 111.793 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.554 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.5 mp -64.2 -47.1 91.38 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.258 0 CA-C-O 116.566 -1.683 . . . . 0.0 113.923 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.411 ' C ' ' N ' ' A' ' 749' ' ' VAL . 0.2 OUTLIER -64.78 -11.22 34.36 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 122.471 2.396 . . . . 0.0 110.644 -176.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . 0.448 HD21 ' HA ' ' A' ' 705' ' ' VAL . 57.5 tp -56.15 -14.93 3.05 Favored 'General case' 0 CA--C 1.562 1.429 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.554 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.273 1.5 t -53.75 -54.17 21.37 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -72.36 -28.87 63.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 122.566 1.174 . . . . 0.0 108.289 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.71 -19.21 27.32 Favored Glycine 0 C--N 1.339 0.726 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.181 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 79.8 p -57.36 -37.32 72.41 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.51 -47.49 85.38 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.13 -35.8 76.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.764 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.24 -45.34 93.76 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.292 0.568 . . . . 0.0 110.275 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.29 -36.88 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -69.45 -30.81 68.81 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.236 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.558 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 79.2 m-20 -57.9 -49.22 77.47 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.614 -0.679 . . . . 0.0 109.938 -178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -70.8 -43.42 68.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.019 0.528 . . . . 0.0 112.256 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 10.6 mt -68.73 -46.28 69.32 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 121.595 0.712 . . . . 0.0 112.565 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -63.23 -25.4 68.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.292 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 61.6 p -74.3 -45.15 49.42 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.572 -0.705 . . . . 0.0 111.158 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.33 -55.52 13.49 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.43 -49.14 4.53 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.709 0.766 . . . . 0.0 112.173 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 5.4 tt 82.98 -78.18 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.875 0.87 . . . . 0.0 111.644 -178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -109.99 -70.65 0.8 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.624 -0.672 . . . . 0.0 111.568 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.9 m -97.86 144.41 27.47 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.142 0.496 . . . . 0.0 110.604 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -60.98 -29.54 69.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.997 0.427 . . . . 0.0 110.419 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -55.94 -36.65 68.0 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.882 0.849 . . . . 0.0 109.226 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.91 -29.6 60.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.671 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 29.5 tp -59.65 -43.53 93.87 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -59.53 -40.04 85.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.574 0.702 . . . . 0.0 109.394 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -68.0 -45.37 74.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.83 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -38.41 91.05 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.392 0.615 . . . . 0.0 110.707 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.33 -39.88 88.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.9 -0.5 . . . . 0.0 111.168 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.9 mt -67.19 -40.64 86.55 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 17.8 pt -60.26 -36.93 71.69 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.56 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 35.2 t -55.59 -46.41 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.774 -0.579 . . . . 0.0 109.597 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -41.53 97.63 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.188 0.518 . . . . 0.0 110.856 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.87 72.49 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.44 -36.75 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 O-C-N 121.714 -0.616 . . . . 0.0 111.078 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 13.4 m -54.73 -40.26 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 O-C-N 121.471 -0.768 . . . . 0.0 111.46 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -65.28 -42.0 93.6 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.68 0.753 . . . . 0.0 111.178 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.9 tp -69.15 -38.79 78.95 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.327 0.584 . . . . 0.0 111.035 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 120.871 0.367 . . . . 0.0 111.312 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.557 0.694 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.9 mp 61.02 103.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.575 0.702 . . . . 0.0 110.556 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -167.11 175.16 7.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.511 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -53.59 -41.41 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.549 0.69 . . . . 0.0 110.363 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -73.31 -31.46 64.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.68 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -46.78 50.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.347 0.594 . . . . 0.0 110.777 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -64.38 -46.28 84.05 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.589 0.709 . . . . 0.0 110.394 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.37 -24.43 67.64 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.4 t -63.18 -35.01 78.89 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.229 0.537 . . . . 0.0 110.923 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.84 -28.12 67.22 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.211 0.529 . . . . 0.0 111.233 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -62.23 -23.53 66.71 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.048 0.452 . . . . 0.0 111.379 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -88.04 -26.6 22.49 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.238 0.542 . . . . 0.0 111.512 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -59.16 -49.11 79.12 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 111.014 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 59.3 41.34 20.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.799 0.809 . . . . 0.0 110.644 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -153.64 -71.33 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.802 -0.561 . . . . 0.0 111.224 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -65.68 -37.21 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 O-C-N 121.869 -0.519 . . . . 0.0 111.344 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.26 -33.72 43.02 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -64.01 -49.88 70.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.439 0.638 . . . . 0.0 110.116 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -65.68 -39.86 91.75 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.828 0.823 . . . . 0.0 109.622 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.6 80.92 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -102.02 -31.2 10.77 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -68.81 -27.01 65.47 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.514 -0.741 . . . . 0.0 111.481 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.7 pp -60.42 -36.08 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 O-C-N 122.091 -0.381 . . . . 0.0 110.889 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -47.23 70.51 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.281 0.563 . . . . 0.0 110.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 3.0 mp -76.06 -36.95 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -28.58 67.49 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.43 -44.78 96.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.54 -43.76 98.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.29 -37.86 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.433 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . 0.407 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 42.4 t -55.81 -39.44 56.23 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -63.63 -27.46 71.02 Favored Glycine 0 CA--C 1.543 1.842 0 O-C-N 121.766 -0.584 . . . . 0.0 112.273 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 46.6 m -60.55 -44.55 96.0 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.421 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.43 -31.55 69.39 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 121.597 -0.69 . . . . 0.0 112.068 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.421 ' H ' HD11 ' B' ' 692' ' ' LEU . 1.0 OUTLIER -57.16 -44.69 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 O-C-N 121.438 -0.789 . . . . 0.0 109.237 -177.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.04 -32.07 80.94 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -36.86 67.23 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.785 0.803 . . . . 0.0 109.89 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.1 mmt180 -54.67 -27.68 41.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . 0.429 HG22 HD11 ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.17 -36.02 55.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 O-C-N 120.85 -1.156 . . . . 0.0 109.325 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 3.0 p -61.78 -30.5 48.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 O-C-N 121.218 -0.926 . . . . 0.0 110.424 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 11.6 m-85 -56.62 -31.41 64.28 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.708 -0.62 . . . . 0.0 110.429 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.34 88.06 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.17 -38.78 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.13 -39.95 91.94 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.363 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -68.37 -33.59 74.54 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.579 0.704 . . . . 0.0 110.01 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -42.78 93.09 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.158 0.98 . . . . 0.0 108.956 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.16 -45.13 77.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 122.153 0.977 . . . . 0.0 109.176 178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.53 -36.59 83.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.336 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 18.3 ttm180 -62.07 -47.12 86.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.25 1.024 . . . . 0.0 109.485 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.6 t -70.28 -44.4 77.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.038 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.47 -44.97 95.34 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.558 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.4 pt20 -104.46 -24.46 13.04 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.11 176.18 14.35 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -96.03 -65.05 1.0 Allowed 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.727 -0.867 . . . . 0.0 111.596 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 713' ' ' SER . . . . . 0.409 ' HA ' HG23 ' A' ' 708' ' ' VAL . 42.9 p -69.48 159.61 82.82 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.353 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -31.63 142.3 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.361 2.041 . . . . 0.0 113.152 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.448 ' O ' ' C ' ' B' ' 716' ' ' SER . 8.3 tt -95.2 -18.9 20.5 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 715' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 122.326 1.06 . . . . 0.0 112.505 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.464 0.65 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -57.99 -26.32 62.2 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.332 0.587 . . . . 0.0 112.369 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -52.34 63.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 9.9 ptt85 -77.72 -34.47 52.66 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -45.06 90.6 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.093 -1.004 . . . . 0.0 108.809 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -71.46 -34.05 69.87 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.283 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 4.3 p -57.28 -38.29 73.7 Favored 'General case' 0 C--N 1.344 0.342 0 O-C-N 122.075 -0.391 . . . . 0.0 110.601 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 28.5 mt -54.1 -19.87 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.553 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 3.0 ttt85 -59.85 -29.68 68.45 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.69 -18.67 8.57 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 122.109 -0.37 . . . . 0.0 110.063 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 43.9 t -56.04 -54.53 26.09 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -73.07 -22.11 60.66 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.27 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.9 -19.84 31.21 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.228 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 6.9 m -58.25 -37.47 74.99 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.799 -0.824 . . . . 0.0 108.968 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.4 tp -66.01 -51.02 62.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.299 0.571 . . . . 0.0 109.757 178.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.37 -36.38 83.83 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.96 -45.0 94.07 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.854 -0.529 . . . . 0.0 111.005 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -65.14 -34.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.711 0.767 . . . . 0.0 109.032 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.5 -30.29 68.11 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.724 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -55.33 -47.96 74.89 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.323 -0.861 . . . . 0.0 109.446 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.35 -45.25 66.49 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.105 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.4 mt -66.73 -46.5 75.28 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -66.65 -22.76 66.1 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 11.8 t -76.82 -45.1 29.9 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.521 0.677 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 5.1 mp -66.77 -54.6 21.11 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.9 p -98.56 -23.39 15.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -177.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 5.2 mp 70.37 -66.9 0.26 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 121.731 -0.606 . . . . 0.0 110.996 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -130.22 -67.06 0.75 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.783 -0.573 . . . . 0.0 110.997 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 7.3 m -97.66 146.44 25.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.332 0.587 . . . . 0.0 110.739 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.98 -31.96 70.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.939 0.4 . . . . 0.0 110.599 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -53.67 -39.08 64.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.822 0.82 . . . . 0.0 109.542 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.57 -29.65 64.62 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.279 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 5.7 tt -59.5 -43.26 93.38 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -37.27 75.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.67 -48.74 75.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -38.12 77.95 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 121.82 0.819 . . . . 0.0 110.05 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.28 -36.66 73.62 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 121.784 -0.573 . . . . 0.0 110.507 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.32 -31.28 67.23 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 22.5 pt -70.27 -36.69 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 121.471 -0.768 . . . . 0.0 109.792 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 39.2 t -55.53 -46.04 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 121.666 -0.646 . . . . 0.0 111.15 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 12.4 t -63.31 -42.67 99.04 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.997 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -37.41 81.54 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.573 -0.705 . . . . 0.0 111.15 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.92 -47.14 94.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 122.05 -0.406 . . . . 0.0 111.32 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.1 -38.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.488 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.17 -46.03 89.45 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.721 0.772 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 31.2 tp -68.7 -40.55 79.98 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.975 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 1.3 tp -78.01 -16.79 57.8 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.98 0.419 . . . . 0.0 111.787 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -49.3 -37.46 24.76 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 -106.12 122.55 46.41 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 122.179 -0.601 . . . . 0.0 110.641 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.67 -179.747 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.418 0.628 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.0 mp -132.13 158.19 42.3 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.391 0.615 . . . . 0.0 111.056 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.66 166.04 2.13 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.664 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -58.37 -48.52 80.35 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.924 0.869 . . . . 0.0 110.089 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.22 -21.82 66.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.52 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -41.44 22.0 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -61.63 -46.45 89.75 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.533 0.682 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.82 -31.91 68.9 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.616 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -57.87 -38.13 75.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.31 -29.31 69.8 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.066 0.46 . . . . 0.0 111.764 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 41.7 m95 -59.53 -28.87 67.46 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.965 -0.46 . . . . 0.0 111.198 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -77.68 -25.1 49.27 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 122.013 -0.43 . . . . 0.0 111.748 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.22 -42.22 90.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.426 0.631 . . . . 0.0 110.579 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.2 t80 53.58 30.97 11.63 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.098 0.475 . . . . 0.0 111.833 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -151.46 -69.85 0.17 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.508 -0.745 . . . . 0.0 112.471 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -37.19 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.474 0.654 . . . . 0.0 111.515 -178.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -51.93 -33.72 38.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.462 -178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -57.08 -49.02 77.14 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.628 0.727 . . . . 0.0 109.576 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -64.78 -44.22 90.68 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 122.004 -0.435 . . . . 0.0 110.416 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.15 -36.1 82.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -98.11 -15.42 19.97 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -98.44 -11.92 21.87 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.329 -0.857 . . . . 0.0 112.295 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.454 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 6.1 pt -61.06 -36.4 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 121.788 -0.57 . . . . 0.0 110.872 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -53.45 -47.32 69.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.962 0.41 . . . . 0.0 110.132 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.9 -34.05 67.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . 0.454 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.79 -33.37 71.63 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.335 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 11.6 mm -60.64 -46.74 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.31 -39.55 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.8 -37.12 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.38 -39.74 45.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.2 -38.98 80.04 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.3 m -67.41 -38.47 84.68 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 122.237 1.018 . . . . 0.0 109.421 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.0 tp -59.74 -46.17 89.95 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.261 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -67.84 -41.61 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.044 -0.41 . . . . 0.0 111.105 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.34 -29.85 69.91 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.01 -37.6 87.83 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 122.005 0.907 . . . . 0.0 110.25 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -55.75 -28.4 55.74 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.2 tt -58.61 -35.51 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.426 -0.796 . . . . 0.0 111.532 -176.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 11.0 p -53.97 -29.94 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.469 -0.769 . . . . 0.0 110.103 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -55.99 -31.5 63.09 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.808 -0.558 . . . . 0.0 110.336 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.47 -37.68 78.84 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.13 -39.28 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.87 -37.22 86.0 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.022 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 52.6 p -62.9 -36.14 82.39 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.761 -0.587 . . . . 0.0 110.621 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -40.49 93.94 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 108.832 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.27 -43.75 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -62.38 -35.66 79.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.364 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -59.52 -51.03 71.61 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.969 0.89 . . . . 0.0 110.355 -178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -45.56 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.925 0.869 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -73.81 -38.09 64.69 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -102.63 -2.52 28.19 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 86.45 -176.13 48.03 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -139.19 -57.96 0.6 Allowed 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.585 -0.95 . . . . 0.0 112.548 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 14.9 p -81.41 149.17 64.63 Favored Pre-proline 0 C--N 1.338 0.103 0 CA-C-O 118.335 -0.84 . . . . 0.0 109.644 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -30.64 94.64 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.429 2.086 . . . . 0.0 112.566 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.52 16.78 1.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.305 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 121.806 0.812 . . . . 0.0 110.34 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 121.66 0.743 . . . . 0.0 111.546 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -72.14 -26.68 62.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.848 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -61.56 -8.26 4.16 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.855 -0.528 . . . . 0.0 112.395 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 63.7 mtm-85 -71.76 -45.27 62.21 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.724 -0.61 . . . . 0.0 111.677 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.4 -38.62 77.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.877 -0.515 . . . . 0.0 109.796 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.12 -42.47 69.18 Favored 'General case' 0 N--CA 1.457 -0.084 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.2 p -58.35 -43.09 88.17 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 122.088 -0.383 . . . . 0.0 110.935 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.3 -21.03 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 O-C-N 121.667 -0.645 . . . . 0.0 109.448 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -59.74 -26.3 65.54 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 109.097 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.5 -24.25 30.48 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.861 0.362 . . . . 0.0 110.104 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.66 -54.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.35 0.627 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -72.3 -24.93 61.4 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.892 0.853 . . . . 0.0 109.19 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.33 -20.75 37.89 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.905 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 1.9 m -58.81 -37.92 77.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.921 0.86 . . . . 0.0 109.775 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 19.1 tp -67.04 -51.42 55.0 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.479 0.657 . . . . 0.0 109.935 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.84 78.88 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.413 0.625 . . . . 0.0 111.828 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.36 -45.11 92.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.101 0.477 . . . . 0.0 110.867 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.04 -34.83 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.517 0.675 . . . . 0.0 109.427 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.26 -30.76 68.94 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -55.76 -49.07 74.11 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 121.033 -1.042 . . . . 0.0 109.987 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -70.47 -44.77 67.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.448 0.642 . . . . 0.0 111.648 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -40.92 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -78.85 -35.57 43.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 15.4 p -64.54 -45.39 87.38 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.628 -0.67 . . . . 0.0 111.276 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -55.79 10.85 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.1 m -99.28 -49.53 4.43 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.419 -0.801 . . . . 0.0 112.67 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 8.7 tp 80.31 106.26 0.07 Allowed 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.884 0.849 . . . . 0.0 110.348 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 70.65 -68.26 0.22 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.64 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 3.3 m -144.47 179.66 7.12 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.356 0.598 . . . . 0.0 111.518 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.5 -162.32 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 11.1 t60 75.78 -59.81 0.51 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -61.96 -30.2 70.76 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.568 177.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.77 -32.59 70.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -35.09 68.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -69.45 -34.47 74.46 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -38.04 77.52 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.004 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.99 -37.01 73.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.648 0.737 . . . . 0.0 109.666 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.12 -38.99 60.88 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.643 0.735 . . . . 0.0 109.584 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 82.7 mt -59.06 -45.47 92.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.853 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 31.1 m -58.54 -44.11 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.313 -0.867 . . . . 0.0 111.42 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 82.3 p -63.89 -46.19 85.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -31.76 72.11 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.133 0.492 . . . . 0.0 111.576 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 58.7 mt -63.89 -47.1 92.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.24 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 33.1 m -54.09 -37.89 36.46 Favored 'Isoleucine or valine' 0 C--N 1.35 0.625 0 CA-C-N 119.72 1.145 . . . . 0.0 110.047 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 . . . . . 0 CA--C 1.543 0.677 0 CA-C-O 121.413 0.625 . . . . 0.0 110.767 178.494 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt -177.08 101.52 0.05 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.543 0.687 . . . . 0.0 109.676 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -173.65 -169.17 0.48 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.165 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.4 tt -48.02 -39.53 20.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.379 0.609 . . . . 0.0 110.821 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.48 -37.08 71.34 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -41.73 51.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.558 0.694 . . . . 0.0 110.739 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -75.15 -45.76 38.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.842 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.17 -35.28 76.13 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.021 0.439 . . . . 0.0 111.907 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.0 m -64.17 -31.03 72.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.526 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.42 -31.14 72.22 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.977 -0.452 . . . . 0.0 111.698 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -59.73 -29.84 68.41 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.778 -0.576 . . . . 0.0 111.08 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -25.57 68.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.183 0.516 . . . . 0.0 111.168 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -60.99 -40.54 93.86 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.59 0.71 . . . . 0.0 110.278 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 23.8 t80 56.34 35.01 25.15 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.559 0.695 . . . . 0.0 111.235 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -155.41 -64.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.714 -0.617 . . . . 0.0 111.649 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.1 tp -68.22 -37.28 77.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 122.061 -0.399 . . . . 0.0 111.568 -179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.56 -33.69 46.91 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 122.095 -0.378 . . . . 0.0 111.727 -178.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -65.88 -49.76 66.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.299 0.571 . . . . 0.0 110.686 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -65.26 -44.6 87.57 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.509 0.671 . . . . 0.0 109.352 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.35 -35.61 81.48 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.964 -0.46 . . . . 0.0 111.729 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -93.28 -14.97 26.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -93.37 -12.95 28.73 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.608 -0.682 . . . . 0.0 111.787 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.1 pp -60.79 -36.57 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 O-C-N 121.872 -0.517 . . . . 0.0 110.442 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.3 ttt-85 -53.77 -47.43 70.74 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.613 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.5 mp -73.84 -35.12 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -27.78 65.26 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.612 -177.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 14.9 mm -60.88 -42.09 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 121.513 0.673 . . . . 0.0 109.247 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 77.2 mt -71.04 -36.75 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.072 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.8 mm -58.6 -37.31 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 O-C-N 122.043 -0.411 . . . . 0.0 109.996 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 98.8 t -54.44 -42.01 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.76 -41.51 66.46 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -65.92 -38.71 89.39 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.834 0.826 . . . . 0.0 109.714 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -45.86 91.16 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.947 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.76 -42.0 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.785 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.42 -24.57 61.74 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.47 -39.22 86.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.014 0.911 . . . . 0.0 109.459 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -56.22 -28.44 58.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.889 0.875 . . . . 0.0 112.812 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.1 -37.21 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 O-C-N 121.17 -0.956 . . . . 0.0 108.67 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.69 -30.65 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 O-C-N 121.533 -0.729 . . . . 0.0 110.239 176.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -55.89 -28.99 59.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.071 0.463 . . . . 0.0 110.405 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.47 -37.0 72.2 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 4.0 m -63.58 -35.99 74.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 119.938 -0.705 . . . . 0.0 109.552 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.8 tp -61.01 -42.3 98.2 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.013 -0.429 . . . . 0.0 110.753 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 60.9 p -62.94 -35.02 78.72 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.371 0.605 . . . . 0.0 110.072 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.44 96.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 122.113 0.958 . . . . 0.0 108.852 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.39 -45.11 94.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -62.91 -36.82 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.914 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . 0.412 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 8.3 ttm180 -60.59 -47.5 85.94 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.43 0.633 . . . . 0.0 110.612 -178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.2 t -75.02 -44.37 44.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 122.188 0.995 . . . . 0.0 108.58 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -66.11 -18.71 65.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.973 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -97.22 -18.82 19.0 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.384 -0.823 . . . . 0.0 112.841 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 116.66 11.27 9.53 Favored Glycine 0 CA--C 1.54 1.601 0 O-C-N 121.385 -0.822 . . . . 0.0 112.751 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' HD3' ' A' ' 707' ' ' ARG . 0.1 OUTLIER 63.32 -121.08 0.56 Allowed 'General case' 0 CA--C 1.565 1.521 0 O-C-N 121.935 -0.744 . . . . 0.0 111.053 179.322 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 713' ' ' SER . . . . . 0.407 ' HA ' HG21 ' C' ' 708' ' ' VAL . 69.7 p -62.77 159.35 45.22 Favored Pre-proline 0 C--N 1.351 0.672 0 O-C-N 120.84 -1.163 . . . . 0.0 111.519 -178.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.67 113.72 0.43 Allowed 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 121.758 1.639 . . . . 0.0 111.758 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.12 -20.27 13.06 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.483 1.225 0 CA-C-O 122.669 1.223 . . . . 0.0 110.876 -179.037 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 122.18 0.99 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 12.4 mtt-85 -58.03 -25.47 61.2 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.759 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -10.8 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 7.1 mtm105 -70.71 -46.18 63.56 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.45 -0.782 . . . . 0.0 109.196 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -59.07 -46.1 89.14 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.191 0.52 . . . . 0.0 111.962 -178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.41 -28.61 63.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.57 0.7 . . . . 0.0 111.67 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 12.2 p -69.51 -36.46 76.47 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.011 -1.056 . . . . 0.0 111.726 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.501 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.9 mp -66.61 -46.79 85.2 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 CA-C-O 117.058 -1.449 . . . . 0.0 114.0 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -13.09 59.41 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 122.715 2.507 . . . . 0.0 109.453 -179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.1 -17.23 38.4 Favored 'General case' 0 C--N 1.363 1.187 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 172.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.3 p -57.63 -44.82 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -70.9 -13.19 61.93 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 122.116 0.96 . . . . 0.0 109.447 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.11 -18.95 21.66 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 124.167 0.889 . . . . 0.0 111.329 -178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 70.6 p -57.38 -37.3 72.45 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 117.645 0.722 . . . . 0.0 109.06 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.93 -51.05 69.67 Favored 'General case' 0 C--N 1.346 0.414 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.86 -35.25 72.66 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.892 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.3 -44.99 92.49 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -61.71 -36.21 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.02 -30.56 70.68 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.625 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.409 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 13.2 m-20 -56.09 -50.15 71.83 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.407 -0.808 . . . . 0.0 109.154 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -71.49 -45.15 63.27 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.686 0.755 . . . . 0.0 111.624 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 1.4 tt -61.53 -38.99 89.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.652 0.739 . . . . 0.0 112.359 -177.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 13.5 ttm105 -82.59 -17.98 42.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 15.9 p -76.23 -46.16 29.48 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.481 -0.762 . . . . 0.0 112.706 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -54.37 16.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 5.1 t -97.86 -49.51 4.78 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.039 0.923 . . . . 0.0 111.556 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 7.9 tt 75.77 -71.3 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.298 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -108.4 -66.31 1.05 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.724 -0.61 . . . . 0.0 111.238 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 2.0 t -104.92 134.3 48.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.076 0.465 . . . . 0.0 110.476 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -55.27 -21.63 15.25 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.981 0.419 . . . . 0.0 110.821 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -60.5 -39.92 89.46 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-O 121.726 0.774 . . . . 0.0 109.24 178.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -55.69 -29.5 59.52 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.837 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.44 -34.77 72.92 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 122.157 -0.339 . . . . 0.0 110.606 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -56.88 -32.92 66.35 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -66.13 -46.84 76.13 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.572 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.91 -38.65 79.4 Favored 'General case' 0 C--N 1.354 0.782 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.441 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 7.5 tt -63.38 -42.6 98.83 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.692 -0.63 . . . . 0.0 111.791 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 43.9 mt -74.57 -39.64 62.13 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.71 -37.44 77.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.427 -178.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 18.4 m -60.4 -42.86 92.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.571 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.028 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 24.2 p -63.79 -44.67 92.68 Favored 'General case' 0 C--N 1.343 0.303 0 O-C-N 122.042 -0.412 . . . . 0.0 111.768 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -33.69 76.13 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.6 mt -54.97 -37.1 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 O-C-N 121.911 -0.493 . . . . 0.0 110.663 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 14.6 m -54.76 -38.15 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 O-C-N 121.209 -0.932 . . . . 0.0 109.69 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.16 -45.36 92.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.555 0.693 . . . . 0.0 110.753 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.89 -43.88 86.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.236 0.541 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.531 0 CA-C-O 120.921 0.391 . . . . 0.0 111.509 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 120.457 0.17 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 176.53 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -176.01 -179.35 1.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.634 0.731 . . . . 0.0 110.924 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -39.05 72.84 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.498 0.666 . . . . 0.0 109.837 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.12 -34.22 77.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.344 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -75.22 -47.12 29.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.087 0.47 . . . . 0.0 110.379 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -68.24 -46.0 71.69 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.501 0.667 . . . . 0.0 111.439 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.64 -19.21 65.82 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.045 -178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.8 66.24 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.063 -0.398 . . . . 0.0 111.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.78 -36.32 78.68 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -59.9 -17.26 35.83 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.846 -0.534 . . . . 0.0 111.239 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -27.17 24.79 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.16 0.505 . . . . 0.0 110.205 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -64.04 -46.62 83.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.545 0.688 . . . . 0.0 110.431 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 21.0 t80 57.65 31.84 20.97 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.517 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -142.93 -70.41 0.33 Allowed 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.719 -0.613 . . . . 0.0 110.907 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.95 -37.5 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.05 -0.406 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.5 -33.87 46.92 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -65.67 -50.32 65.37 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.712 -0.617 . . . . 0.0 110.701 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -65.76 -42.45 90.88 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 122.017 0.913 . . . . 0.0 109.76 178.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -39.17 93.8 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.14 -178.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -97.15 -28.2 14.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -77.11 -15.59 59.5 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.468 -0.77 . . . . 0.0 111.901 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.487 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 5.9 pt -60.78 -37.35 75.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.894 -0.504 . . . . 0.0 111.006 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -53.66 -47.35 70.45 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.912 0.387 . . . . 0.0 110.805 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -70.64 -35.17 59.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.487 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.97 -27.89 67.2 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.205 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 18.1 mm -60.62 -48.2 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 O-C-N 121.827 -0.546 . . . . 0.0 109.789 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -64.88 -41.1 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.99 -38.06 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.22 -44.3 98.94 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.18 -26.7 9.5 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 13.7 m -60.52 -46.11 91.37 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.41 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.82 -32.89 71.07 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.364 -0.835 . . . . 0.0 112.504 -177.558 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.41 ' H ' HD11 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -58.99 -47.02 91.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.96 -27.21 66.66 Favored Glycine 0 CA--C 1.541 1.699 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -37.25 77.34 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.04 0.924 . . . . 0.0 110.089 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 12.8 mmt180 -55.39 -27.85 50.3 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -179.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.74 -36.86 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 O-C-N 121.028 -1.045 . . . . 0.0 109.01 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.41 -30.69 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 O-C-N 121.722 -0.611 . . . . 0.0 110.327 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.0 m-85 -56.49 -31.26 63.89 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.871 -0.518 . . . . 0.0 110.153 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.61 78.7 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -37.73 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.665 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.5 tp -56.86 -37.92 71.99 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.761 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 51.0 m -62.83 -36.15 82.25 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.18 0.514 . . . . 0.0 110.837 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -44.85 90.34 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 122.238 1.018 . . . . 0.0 108.826 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 76.9 t -65.36 -45.14 94.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 122.522 1.153 . . . . 0.0 109.211 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -62.69 -35.87 81.08 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.557 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -65.74 -49.41 68.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.488 0.661 . . . . 0.0 112.323 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -44.17 31.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.25 -45.35 91.43 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -175.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.409 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 2.4 pt20 -104.67 -24.56 12.94 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.67 177.31 14.84 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -113.43 -62.68 1.56 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.736 -0.861 . . . . 0.0 112.804 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 8.4 p -62.76 159.3 45.5 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.388 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -29.81 108.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 122.76 2.307 . . . . 0.0 112.961 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.9 tt -67.02 -16.72 64.54 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 121.763 0.792 . . . . 0.0 109.547 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.488 0.661 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -58.6 -26.86 64.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.167 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -55.72 -12.28 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -68.41 -40.97 81.08 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.563 -0.711 . . . . 0.0 111.567 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -58.5 -41.14 84.69 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.506 -0.746 . . . . 0.0 110.664 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.26 -36.96 71.95 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.244 0.545 . . . . 0.0 110.021 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 8.9 p -56.96 -46.22 82.31 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 122.056 -0.402 . . . . 0.0 110.44 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.8 mp -53.34 -19.22 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.081 179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -28.13 66.61 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 4.2 pp -55.61 -21.29 16.94 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.941 0.401 . . . . 0.0 110.374 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 48.4 t -55.61 -53.95 31.11 Favored 'Isoleucine or valine' 0 C--N 1.35 0.596 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -72.61 -22.66 60.93 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.689 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.23 -20.68 36.85 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.999 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 18.4 m -59.5 -38.97 82.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 117.884 0.842 . . . . 0.0 109.631 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 16.9 tp -67.89 -51.18 51.0 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.436 0.636 . . . . 0.0 109.995 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.55 81.0 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.3 0.571 . . . . 0.0 111.513 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 5.7 tt -60.81 -45.49 94.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.903 0.382 . . . . 0.0 111.618 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 54.8 mt -65.64 -37.32 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 121.654 0.74 . . . . 0.0 109.229 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.13 -30.06 68.24 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.673 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -55.35 -46.91 76.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.531 -0.731 . . . . 0.0 109.767 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.36 -45.23 66.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-O 121.063 0.458 . . . . 0.0 112.166 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 43.4 mt -69.2 -45.35 70.13 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.475 0.655 . . . . 0.0 112.748 -178.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -60.86 -43.19 98.7 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.8 m -59.69 -42.97 94.16 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.413 -0.805 . . . . 0.0 111.323 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -54.23 20.01 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.81 -48.11 5.32 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.653 0.739 . . . . 0.0 112.051 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 78.21 -54.74 0.49 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.654 0.782 . . . . 0.0 111.343 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -137.51 119.46 15.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 111.236 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 16.7 m 54.02 177.3 0.02 OUTLIER 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.147 0.499 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -97.49 -2.11 42.67 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.958 -0.464 . . . . 0.0 111.621 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -74.3 -43.15 57.99 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -62.24 -29.96 70.76 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.262 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.79 -31.08 69.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -56.94 -35.61 69.28 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.466 0.651 . . . . 0.0 109.425 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -69.02 -34.93 76.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.311 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -37.95 76.51 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.023 0.439 . . . . 0.0 110.576 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.34 -36.54 73.58 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 0.0 111.65 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.35 -48.09 71.37 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.775 -0.578 . . . . 0.0 111.623 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 17.4 pt -56.35 -34.94 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 O-C-N 122.004 -0.435 . . . . 0.0 110.4 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 56.2 t -53.44 -43.16 51.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.06 -36.49 84.18 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.75 0.786 . . . . 0.0 110.22 177.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -63.33 -36.43 83.65 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.155 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 3.7 mm -54.79 -55.45 15.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 O-C-N 122.11 -0.369 . . . . 0.0 110.933 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 31.3 m -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.39 0.614 . . . . 0.0 110.355 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.98 -42.05 99.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.196 0.522 . . . . 0.0 111.474 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 12.1 tp -68.66 -39.43 80.64 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.956 0.884 . . . . 0.0 110.226 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.99 -23.0 52.29 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.459 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.58 -54.62 8.74 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.32 125.4 37.9 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.402 0.62 . . . . 0.0 110.323 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.632 -179.474 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.385 0.612 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 7.1 mp 56.84 102.71 0.02 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 121.587 0.708 . . . . 0.0 110.585 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -164.13 171.07 15.57 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.717 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 10.5 tt -51.93 -61.93 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.588 0.708 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.81 -16.61 63.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.279 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -81.22 -46.15 15.25 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 122.06 -0.4 . . . . 0.0 111.194 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -64.84 -45.98 83.82 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.667 0.746 . . . . 0.0 110.013 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.32 -21.21 66.25 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.431 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 48.4 t -69.63 -29.69 67.24 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.884 -0.51 . . . . 0.0 111.483 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.85 -37.66 79.91 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.129 0.49 . . . . 0.0 110.795 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -59.87 -18.94 48.29 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 111.297 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -81.21 -28.33 34.94 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.425 0.631 . . . . 0.0 110.777 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -60.05 -46.51 89.3 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.586 0.708 . . . . 0.0 110.209 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.23 36.62 27.62 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.428 0.632 . . . . 0.0 111.66 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.6 -73.36 0.14 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.734 -0.604 . . . . 0.0 111.772 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -37.33 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.366 0.603 . . . . 0.0 111.608 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.76 -33.72 36.23 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.918 -0.488 . . . . 0.0 111.983 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -60.63 -50.19 74.52 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.721 -0.612 . . . . 0.0 109.665 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -65.67 -40.08 92.02 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 121.761 0.791 . . . . 0.0 109.815 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -35.78 81.93 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -104.91 -20.52 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -176.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -86.97 -12.94 46.04 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.48 -0.763 . . . . 0.0 112.159 -179.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.1 pp -60.75 -36.35 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 122.033 -0.417 . . . . 0.0 110.329 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -53.9 -47.1 71.48 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.934 0.397 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.34 -36.35 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -33.73 72.12 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.955 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 7.8 mm -60.95 -52.01 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.074 0.464 . . . . 0.0 110.083 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 61.3 mt -62.84 -37.07 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 121.709 0.766 . . . . 0.0 108.934 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.57 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.7 t -55.16 -40.03 53.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.65 -39.49 75.86 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -67.66 -38.77 84.23 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.976 0.893 . . . . 0.0 109.384 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -46.33 90.2 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.224 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -65.27 -41.91 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 121.353 0.596 . . . . 0.0 109.848 -178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.76 -25.9 64.3 Favored Glycine 0 CA--C 1.539 1.588 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -58.38 -37.8 75.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.723 0.773 . . . . 0.0 110.271 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -55.44 -28.71 56.02 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.1 tt -58.79 -36.44 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 120.874 -1.141 . . . . 0.0 111.804 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.8 p -59.1 -30.39 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.271 -0.893 . . . . 0.0 110.19 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -56.41 -30.71 63.11 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.839 -0.538 . . . . 0.0 110.18 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.81 -37.78 77.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -44.33 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.97 -36.95 75.7 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.72 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 66.6 m -62.05 -37.26 84.29 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -40.91 95.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 122.0 0.905 . . . . 0.0 108.779 178.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.69 -44.98 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.693 178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -62.79 -36.29 82.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.49 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.58 -48.69 78.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.8 0.81 . . . . 0.0 110.296 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . 0.407 HG21 ' HA ' ' A' ' 713' ' ' SER . 1.2 t -76.0 -43.96 38.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.978 -178.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -73.07 -36.23 66.82 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.482 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -102.48 -7.66 21.72 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 99.83 166.29 29.34 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -110.83 -63.0 1.45 Allowed 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.715 -0.874 . . . . 0.0 111.681 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 76.3 p -90.57 159.62 40.73 Favored Pre-proline 0 C--O 1.234 0.273 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.209 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_exo -38.93 119.32 0.43 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.561 1.508 . . . . 0.0 111.801 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 3.0 tt -96.47 4.52 52.05 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -175.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.928 0.87 . . . . 0.0 112.047 -179.449 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 . . . . . 0 C--O 1.234 0.274 0 CA-C-O 122.172 0.987 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -65.67 -26.71 67.91 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.584 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -55.98 -15.21 3.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . 0.402 ' HA ' ' OG ' ' C' ' 745' ' ' SER . 45.6 mtm-85 -56.06 -33.45 65.02 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.82 -0.55 . . . . 0.0 110.8 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -58.28 -40.25 81.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.618 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -47.83 54.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.058 0.456 . . . . 0.0 110.455 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 745' ' ' SER . . . . . 0.402 ' OG ' ' HA ' ' C' ' 742' ' ' ARG . 2.3 p -57.01 -34.88 68.6 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -23.23 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 O-C-N 121.658 -0.651 . . . . 0.0 109.856 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -60.18 -24.35 64.69 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.553 0.692 . . . . 0.0 110.069 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.37 -26.34 67.77 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.904 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 82.3 t -55.81 -53.91 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -72.69 -22.84 60.84 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.588 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -22.88 46.66 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.906 -177.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 38.1 t -61.2 -41.2 96.41 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.832 -0.805 . . . . 0.0 109.543 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.9 tp -68.12 -46.23 71.48 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 109.938 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.98 -35.56 81.1 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.689 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -60.0 -45.43 92.76 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.268 0.556 . . . . 0.0 110.72 -178.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . 0.408 HD11 HG21 ' C' ' 756' ' ' ILE . 45.5 mm -67.43 -40.95 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.138 0.97 . . . . 0.0 108.723 178.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.44 -30.34 71.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.529 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -55.24 -44.0 75.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.552 -0.717 . . . . 0.0 110.892 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.13 -45.12 67.5 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.309 0.576 . . . . 0.0 110.891 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 26.9 mt -67.26 -40.22 86.2 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -67.29 -50.63 59.55 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 1.3 m -68.35 -43.3 77.74 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.228 1.013 . . . . 0.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.55 -52.68 56.41 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.96 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.79 -34.02 11.04 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.127 -0.983 . . . . 0.0 113.418 -177.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.03 177.25 0.24 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -38.14 -66.3 0.27 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 30.9 m -97.17 162.01 13.55 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.853 -0.529 . . . . 0.0 110.649 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.29 -29.7 62.9 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.839 0.352 . . . . 0.0 110.676 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -53.83 -32.04 51.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.815 0.817 . . . . 0.0 109.471 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 -69.91 -30.54 67.97 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.04 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.4 -43.39 96.73 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -56.78 -36.97 70.47 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.494 0.664 . . . . 0.0 109.428 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -69.17 -39.42 78.75 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.23 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.12 -38.11 89.61 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 121.087 0.47 . . . . 0.0 110.855 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 5.7 mp -58.4 -37.79 76.02 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.269 0.557 . . . . 0.0 110.256 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 57.4 mt -74.81 -36.72 62.45 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.486 0.66 . . . . 0.0 110.06 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 40.2 mt -61.26 -47.88 91.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.719 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.06 -39.33 57.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 O-C-N 121.641 -0.662 . . . . 0.0 111.182 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 779' ' ' THR . . . . . 0.404 ' O ' HG21 ' C' ' 782' ' ' VAL . 4.2 m -61.01 -47.95 84.08 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.402 -0.811 . . . . 0.0 110.978 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -68.23 -36.53 79.64 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.809 -0.557 . . . . 0.0 111.535 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.93 -38.23 44.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 CA-C-O 118.644 -0.693 . . . . 0.0 111.954 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.404 HG21 ' O ' ' C' ' 779' ' ' THR . 14.2 m -53.2 -36.79 26.26 Favored 'Isoleucine or valine' 0 C--N 1.354 0.787 0 CA-C-N 120.169 1.35 . . . . 0.0 109.092 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 . . . . . 0 CA--C 1.553 1.088 0 O-C-N 121.344 -0.848 . . . . 0.0 110.688 178.282 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 37.4 mt 61.46 113.23 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.598 0.713 . . . . 0.0 110.306 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -177.55 179.11 0.96 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.75 -41.81 67.51 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.365 0.603 . . . . 0.0 110.367 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -73.71 -32.87 64.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -78.01 -44.36 26.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.135 0.493 . . . . 0.0 111.199 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -65.04 -45.3 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.189 0.518 . . . . 0.0 110.475 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.35 -20.91 65.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.223 0.535 . . . . 0.0 111.362 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.8 t -65.17 -39.4 92.88 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.89 -27.69 66.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.039 0.447 . . . . 0.0 111.873 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.0 m95 -60.18 -24.6 64.9 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.822 -0.549 . . . . 0.0 112.132 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.61 -15.59 39.3 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.651 -0.655 . . . . 0.0 111.861 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -65.66 -45.98 80.89 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.497 0.665 . . . . 0.0 110.378 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 45.9 t80 58.42 42.49 21.16 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -161.02 -69.28 0.06 Allowed 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.653 -0.654 . . . . 0.0 111.733 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.33 -36.7 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 122.095 -0.378 . . . . 0.0 111.923 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 6.9 m -52.04 -34.5 43.6 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -65.83 -50.07 65.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.381 0.61 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -65.72 -44.13 86.99 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.698 0.761 . . . . 0.0 110.345 178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -36.0 82.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -95.51 -42.82 8.26 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -70.69 -3.71 19.9 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.557 -0.715 . . . . 0.0 112.755 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.91 -36.66 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.672 -0.642 . . . . 0.0 110.038 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 9.7 ttt-85 -56.99 -47.13 81.53 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.177 0.513 . . . . 0.0 110.478 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.59 -33.2 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -28.48 69.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.584 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.0 mm -60.95 -48.07 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.292 0.568 . . . . 0.0 109.656 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 80.1 mt -60.36 -36.94 72.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.09 -38.35 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -55.21 -40.86 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.88 -33.27 77.74 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -66.73 -38.71 87.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.95 0.881 . . . . 0.0 110.998 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -46.03 90.69 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -61.43 -41.65 90.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 O-C-N 121.716 -0.615 . . . . 0.0 109.764 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.22 -39.76 97.62 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 178.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.43 -40.37 96.35 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.869 0.842 . . . . 0.0 109.7 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -28.08 55.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.66 0.784 . . . . 0.0 112.188 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.9 -34.8 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.551 -0.718 . . . . 0.0 109.41 -177.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 5.1 p -53.81 -29.1 17.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 O-C-N 121.534 -0.729 . . . . 0.0 110.307 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -54.77 -28.68 50.53 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.808 -0.558 . . . . 0.0 110.504 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -36.57 70.19 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.3 m -61.29 -35.83 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 CA-C-O 121.674 0.75 . . . . 0.0 109.474 177.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.74 -41.95 96.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.11 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 56.3 p -62.48 -31.92 72.74 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.641 0.734 . . . . 0.0 109.679 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.48 -47.14 87.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.662 1.22 . . . . 0.0 108.667 177.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 80.7 t -64.63 -45.15 96.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.363 -1.289 . . . . 0.0 109.29 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 7.8 m120 -62.31 -36.98 83.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 38.3 ttm105 -57.57 -48.46 79.29 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.725 -1.235 . . . . 0.0 110.083 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.5 t -76.42 -44.45 35.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.404 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.98 -16.03 61.08 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . 0.498 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 1.8 tt0 -101.26 -8.45 22.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.031 -1.043 . . . . 0.0 113.468 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.38 18.1 10.68 Favored Glycine 0 CA--C 1.541 1.664 0 O-C-N 121.824 -0.548 . . . . 0.0 112.55 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 54.13 -125.03 2.27 Favored 'General case' 0 CA--C 1.566 1.567 0 O-C-N 121.831 -0.805 . . . . 0.0 110.243 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.13 159.71 36.4 Favored Pre-proline 0 C--N 1.353 0.734 0 O-C-N 120.754 -1.216 . . . . 0.0 109.689 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -45.4 104.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 121.177 1.251 . . . . 0.0 111.56 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.24 -20.33 16.65 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -177.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.549 0.909 0 CA-C-O 122.24 1.019 . . . . 0.0 111.052 -179.769 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.708 0.766 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -57.84 -25.28 60.47 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.001 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -12.33 0.68 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -177.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -42.26 89.18 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.479 -0.763 . . . . 0.0 109.021 177.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -64.91 -36.1 83.27 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -36.67 77.05 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.69 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.5 p -63.76 -45.3 90.46 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 40.7 mt -55.32 -21.11 8.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.973 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -59.86 -30.48 69.0 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.629 -0.669 . . . . 0.0 109.201 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.07 -16.69 53.96 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.167 0.508 . . . . 0.0 110.315 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.57 -55.12 16.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.885 0 O-C-N 120.96 -1.088 . . . . 0.0 108.123 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.96 -22.0 60.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 122.507 1.146 . . . . 0.0 108.953 174.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.72 -19.65 29.1 Favored Glycine 0 C--O 1.219 -0.843 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 88.3 p -57.98 -37.65 74.62 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.046 0.923 . . . . 0.0 109.065 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.2 tp -66.64 -51.1 60.02 Favored 'General case' 0 C--N 1.343 0.294 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.41 73.38 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.087 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.67 -45.07 90.21 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.931 -0.481 . . . . 0.0 111.696 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.73 -34.2 61.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.7 -29.48 66.9 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.941 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.523 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 20.2 m-20 -54.6 -49.02 71.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.324 -0.86 . . . . 0.0 109.686 -177.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.68 -44.93 65.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.527 0.679 . . . . 0.0 111.327 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 3.6 mt -65.74 -29.79 70.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 70.7 mtt180 -73.59 -27.79 61.48 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -45.74 39.43 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.368 -0.832 . . . . 0.0 110.446 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.96 -54.94 12.62 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 -49.19 4.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.612 0.72 . . . . 0.0 111.785 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 4.5 tt 79.21 -66.9 0.17 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.432 0.693 . . . . 0.0 110.988 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -112.64 -61.33 1.74 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.751 -0.593 . . . . 0.0 111.794 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 1.3 m -120.23 157.64 28.68 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.264 0.554 . . . . 0.0 110.732 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -21.16 66.06 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.769 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 65.0 m-70 -56.85 -42.0 78.94 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.307 1.051 . . . . 0.0 108.327 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -28.62 69.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.424 177.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -37.47 75.65 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.99 -32.89 72.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.21 -47.52 73.59 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 122.206 -0.309 . . . . 0.0 111.053 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 tp -61.13 -37.8 84.12 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.977 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 25.6 mt -58.59 -36.41 73.96 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.83 -0.544 . . . . 0.0 112.045 -177.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 32.5 mt -74.55 -48.54 26.28 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.495 -0.753 . . . . 0.0 111.632 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.9 pp -70.69 -37.36 68.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 O-C-N 122.178 -0.326 . . . . 0.0 111.619 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 9.8 p -58.71 -44.34 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 21.0 p -64.06 -35.56 81.15 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-O 122.223 1.011 . . . . 0.0 109.504 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -60.79 -45.42 94.45 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 2.7 pt -64.53 -41.94 93.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.108 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.67 -38.6 82.69 Favored 'Isoleucine or valine' 0 C--N 1.346 0.451 0 CA-C-N 119.066 0.848 . . . . 0.0 111.025 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.41 -45.6 83.32 Favored 'General case' 0 C--N 1.35 0.588 0 O-C-N 121.715 -0.616 . . . . 0.0 111.031 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -40.21 73.72 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.382 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 3.6 tp . . . . . 0 C--O 1.214 -0.792 0 O-C-N 122.06 -0.4 . . . . 0.0 110.861 -178.375 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.2 mm? 54.74 96.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.554 0.692 . . . . 0.0 110.483 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -173.39 164.99 4.71 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.14 -37.64 67.22 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.471 0.653 . . . . 0.0 109.9 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -65.28 -36.92 85.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.699 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 10.9 tttm -80.63 -49.22 11.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.218 0.532 . . . . 0.0 110.125 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -56.53 -44.28 80.66 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.462 0.649 . . . . 0.0 110.029 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.66 -28.95 69.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.362 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 23.0 t -62.07 -36.82 82.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 111.242 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.78 -23.73 63.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 122.055 -0.403 . . . . 0.0 111.719 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -59.55 -29.0 67.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.32 0.581 . . . . 0.0 110.288 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.05 -7.71 56.62 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.212 0.53 . . . . 0.0 110.846 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . 0.44 ' O ' ' N ' ' B' ' 674' ' ' ASP . 14.4 m95 -94.54 34.64 1.29 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.333 0.587 . . . . 0.0 109.802 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -39.81 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 122.087 0.946 . . . . 0.0 113.35 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . 0.44 ' N ' ' O ' ' B' ' 672' ' ' TRP . 1.6 t70 177.7 -66.07 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.672 0.748 . . . . 0.0 110.134 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.69 -36.93 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.099 0.56 . . . . 0.0 112.022 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.4 m -51.6 -33.74 34.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -64.38 -50.02 69.33 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 121.744 -0.597 . . . . 0.0 109.884 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -65.64 -43.05 90.64 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.748 0.785 . . . . 0.0 109.52 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.72 80.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 15.4 t90 -100.48 -45.9 5.4 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -63.55 -7.21 6.47 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.594 -0.691 . . . . 0.0 112.398 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 1.8 pp -60.44 -36.43 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 O-C-N 121.652 -0.655 . . . . 0.0 110.418 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -53.7 -47.35 70.59 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.048 -0.408 . . . . 0.0 111.131 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.1 mp -69.01 -36.05 71.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -31.41 69.75 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.607 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 14.1 mm -60.68 -46.56 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.74 -41.45 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.29 -37.74 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 53.5 t -59.11 -40.12 80.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.89 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.23 -27.22 67.16 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.752 -0.592 . . . . 0.0 111.822 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.0 m -60.66 -41.43 95.0 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -177.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.412 ' CD1' ' O ' ' B' ' 689' ' ' VAL . 0.4 OUTLIER -59.3 -33.2 70.8 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 121.486 -0.759 . . . . 0.0 112.372 -176.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.411 ' H ' HD13 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -66.27 -40.38 86.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 121.453 -0.779 . . . . 0.0 109.896 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.89 -33.94 85.4 Favored Glycine 0 CA--C 1.543 1.807 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.81 -37.22 76.18 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.866 0.841 . . . . 0.0 110.323 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -27.5 45.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.447 1.099 . . . . 0.0 113.832 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 20.8 tt -57.71 -34.86 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.26 -0.9 . . . . 0.0 109.704 -177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 5.2 p -53.52 -28.93 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 O-C-N 121.603 -0.686 . . . . 0.0 110.002 178.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -55.39 -30.7 60.89 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.612 -0.68 . . . . 0.0 109.993 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.77 78.0 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.5 -41.13 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.78 -37.78 80.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.303 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 44.1 p -62.47 -41.69 98.95 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.57 -178.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.85 -40.58 89.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.677 0.751 . . . . 0.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.34 -43.61 87.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -62.72 -36.58 83.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.348 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -65.65 -49.39 68.82 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.703 1.239 . . . . 0.0 109.49 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 9.4 t -77.4 -45.37 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -63.91 -44.81 91.83 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -174.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.523 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 7.9 pt20 -104.59 -24.14 13.03 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.95 165.11 10.13 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -106.7 -57.28 2.08 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.195 -0.591 . . . . 0.0 112.166 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 65.7 p -74.83 159.16 83.68 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.313 -0.851 . . . . 0.0 108.792 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -32.89 124.5 0.11 Allowed 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.238 1.959 . . . . 0.0 112.376 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.6 tt -79.09 -14.93 58.84 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 121.945 0.878 . . . . 0.0 112.538 -178.798 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.628 0 CA-C-O 121.39 0.614 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -71.34 -26.5 62.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.105 0.479 . . . . 0.0 111.259 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.5 -10.58 0.67 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -56.13 -30.73 62.54 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.365 -0.834 . . . . 0.0 110.311 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.49 -41.66 97.6 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -37.17 72.21 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.567 178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 63.2 p -56.93 -36.0 69.73 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.2 mp -55.34 -18.3 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -59.48 -28.13 66.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -21.75 18.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.094 0.474 . . . . 0.0 109.856 177.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 54.1 t -55.84 -54.19 29.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -72.94 -24.48 60.81 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.436 174.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.08 33.57 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.77 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.68 -37.94 77.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.001 0.901 . . . . 0.0 108.948 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.78 -49.4 58.95 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.4 0.619 . . . . 0.0 109.762 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.41 80.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.248 0.547 . . . . 0.0 112.359 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.4 tt -60.24 -45.53 92.93 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.425 0.631 . . . . 0.0 110.882 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.73 -39.29 85.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 122.004 0.907 . . . . 0.0 108.653 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.44 68.62 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.082 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . 0.427 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 85.7 m-20 -55.15 -49.07 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.456 -0.777 . . . . 0.0 110.963 -177.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -70.3 -40.86 73.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.109 0.481 . . . . 0.0 110.809 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.1 mt -69.15 -31.06 69.47 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.6 -49.75 56.91 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.828 -0.545 . . . . 0.0 112.271 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 4.0 m -69.18 -41.07 77.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.743 0.782 . . . . 0.0 110.921 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.99 -53.31 59.31 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.471 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 23.1 t -97.35 -10.74 25.02 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.526 -0.734 . . . . 0.0 112.966 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 mt 68.7 -73.47 0.09 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -138.76 -77.23 0.36 Allowed 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.864 -0.523 . . . . 0.0 110.08 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m -79.73 148.78 31.38 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.853 -0.529 . . . . 0.0 110.125 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -37.38 82.89 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.099 0.476 . . . . 0.0 110.122 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -54.46 -39.62 67.64 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.682 0.753 . . . . 0.0 109.494 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -59.49 -30.07 68.3 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.038 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 3.8 tt -60.11 -38.41 82.91 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -40.52 85.19 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.23 -43.86 93.62 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -36.91 77.0 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 121.694 0.759 . . . . 0.0 110.539 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.85 -35.98 69.5 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.481 -0.762 . . . . 0.0 109.846 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.58 -37.65 88.28 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.85 -0.531 . . . . 0.0 110.797 178.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 9.9 pt -69.64 -35.49 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 O-C-N 121.63 -0.669 . . . . 0.0 109.393 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 72.6 t -54.04 -46.21 65.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 4.8 t -64.02 -34.84 78.91 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.224 -0.922 . . . . 0.0 109.824 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -31.23 70.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 121.278 0.561 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . 0.415 ' CD1' HG13 ' C' ' 746' ' ' ILE . 39.3 mm -54.35 -55.37 15.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.571 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.39 -38.75 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-O 121.655 0.741 . . . . 0.0 110.875 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.88 -41.87 95.27 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.745 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.37 -43.9 69.18 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.324 0.583 . . . . 0.0 111.285 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' C' ' 747' ' ' ARG . 5.4 tp -87.37 -9.37 55.0 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.63 -38.62 82.68 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.96 109.92 19.1 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 122.286 -0.538 . . . . 0.0 110.084 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.22 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.937 0 CA-C-O 120.419 0.152 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 36.4 mt 56.04 99.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.48 0.657 . . . . 0.0 110.546 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.77 168.04 12.69 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.325 0.583 . . . . 0.0 110.236 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -43.58 -51.74 6.7 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.451 0.643 . . . . 0.0 112.232 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.9 -28.0 63.21 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -81.32 -32.27 33.15 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 122.05 -0.406 . . . . 0.0 111.496 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -68.75 -46.35 69.05 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.236 0.541 . . . . 0.0 110.38 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.04 84.64 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.992 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -26.04 67.78 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.398 0.618 . . . . 0.0 110.63 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -34.37 74.21 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.16 0.505 . . . . 0.0 110.898 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -75.59 -14.57 60.39 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 122.13 -0.356 . . . . 0.0 111.749 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.64 -33.78 75.65 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.587 0.708 . . . . 0.0 110.334 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m0 -55.99 -40.09 72.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.595 0.712 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.54 43.25 23.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.78 0.8 . . . . 0.0 111.398 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -159.69 -65.52 0.07 Allowed 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.62 -0.675 . . . . 0.0 112.016 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -38.24 80.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 121.444 0.64 . . . . 0.0 111.432 -178.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.2 m -52.94 -33.79 52.46 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -62.11 -50.05 73.46 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.817 -0.552 . . . . 0.0 111.69 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -44.23 88.07 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.431 0.634 . . . . 0.0 109.389 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.28 -35.78 81.95 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.069 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -95.93 -20.51 18.7 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.72 -19.18 29.54 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.714 -0.616 . . . . 0.0 111.648 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.479 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 7.6 pt -60.66 -36.8 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 O-C-N 121.836 -0.54 . . . . 0.0 110.321 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -55.02 -47.15 75.11 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.172 0.51 . . . . 0.0 110.036 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -67.8 -33.87 64.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . 0.479 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -60.17 -29.78 68.9 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.859 179.643 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 8.0 mm -64.42 -47.4 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.305 0.574 . . . . 0.0 109.708 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.3 mt -64.74 -39.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.92 -37.71 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.8 -40.91 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.61 -41.32 64.79 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.0 m -66.73 -38.5 86.81 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.864 0.84 . . . . 0.0 109.497 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.35 -43.7 92.77 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.171 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -42.23 83.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.58 -34.14 84.75 Favored Glycine 0 CA--C 1.535 1.338 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.82 -36.93 63.04 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.322 1.058 . . . . 0.0 110.173 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -55.62 -28.59 56.1 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.8 tp -59.27 -36.59 64.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 O-C-N 121.076 -1.015 . . . . 0.0 112.083 -175.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -56.51 -30.74 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.294 -0.879 . . . . 0.0 110.439 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -58.59 -31.75 68.33 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.8 -45.45 92.29 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.93 -39.31 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.643 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.75 -37.68 87.53 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.78 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -68.37 -37.81 80.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.219 0.533 . . . . 0.0 110.596 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.39 -40.83 93.95 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.873 0.844 . . . . 0.0 108.955 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 71.6 t -67.63 -45.57 84.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.981 0.896 . . . . 0.0 108.947 178.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -63.15 -36.49 83.78 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.418 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -49.57 74.16 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.551 0.691 . . . . 0.0 111.119 -177.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 4.2 p -77.19 -41.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.599 0.714 . . . . 0.0 112.453 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.7 -40.22 63.78 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 0.1 OUTLIER -101.93 -21.34 14.55 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -175.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.08 170.93 12.78 Favored Glycine 0 N--CA 1.474 1.169 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -131.79 -53.93 1.0 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.03 -0.688 . . . . 0.0 111.86 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 51.5 p -90.35 152.26 45.39 Favored Pre-proline 0 C--O 1.232 0.144 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.748 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -35.89 98.59 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.397 2.064 . . . . 0.0 111.63 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.3 16.21 0.64 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -176.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.472 0.651 0 CA-C-O 121.794 0.807 . . . . 0.0 110.017 178.856 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 122.271 1.034 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -62.32 -26.36 68.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.958 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.03 -19.31 6.7 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.754 -0.591 . . . . 0.0 111.815 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . 0.469 ' O ' HD12 ' C' ' 746' ' ' ILE . 11.4 mtm105 -66.25 -32.84 74.5 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.246 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.55 -37.28 72.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -71.28 -36.57 71.73 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.858 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.1 p -56.82 -25.29 55.59 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.13 -0.356 . . . . 0.0 110.522 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . 0.469 HD12 ' O ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -52.79 -32.42 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.561 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . 0.42 ' HA ' HD22 ' B' ' 785' ' ' LEU . 0.7 OUTLIER -59.6 -23.3 62.85 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.265 0.555 . . . . 0.0 111.648 179.781 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 tt -72.19 -33.94 68.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.006 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.73 -54.03 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.8 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -72.47 -13.89 61.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.759 0.79 . . . . 0.0 110.012 174.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.78 -20.83 41.66 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 121.973 -0.454 . . . . 0.0 112.71 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 2.4 m -58.85 -40.99 85.93 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 117.751 0.776 . . . . 0.0 109.839 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -68.59 -48.17 64.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.608 0.718 . . . . 0.0 109.557 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.1 -35.3 73.18 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.213 0.53 . . . . 0.0 111.291 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.5 tt -59.65 -45.04 93.22 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.457 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.13 -40.69 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 109.818 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.26 -32.37 71.53 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.75 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -59.07 -39.26 81.55 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.533 -0.729 . . . . 0.0 109.124 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.41 -45.6 65.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.65 0.738 . . . . 0.0 111.509 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.41 -41.66 76.11 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.319 0.581 . . . . 0.0 112.564 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.41 -41.51 69.48 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.6 p -64.47 -45.48 87.19 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -55.0 11.84 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.683 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 764' ' ' SER . . . . . 0.449 ' O ' ' HB3' ' C' ' 765' ' ' LEU . 2.3 m -98.85 -43.46 6.74 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' C' ' 764' ' ' SER . 60.2 tp 85.71 -62.97 0.06 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.128 0.971 . . . . 0.0 110.36 -176.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.2 -74.13 0.46 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.486 -0.759 . . . . 0.0 111.887 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 68.2 m -106.58 159.47 16.16 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.734 -0.603 . . . . 0.0 111.125 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.35 -28.2 67.98 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 110.267 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -60.16 -40.6 90.48 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -30.74 69.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.286 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.3 -30.88 69.77 Favored 'General case' 0 C--N 1.344 0.366 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -39.27 73.93 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -65.51 -36.13 82.91 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.846 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.72 -37.91 77.18 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 121.489 0.662 . . . . 0.0 109.817 178.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 5.8 tp -57.45 -36.41 71.38 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.553 0.692 . . . . 0.0 109.431 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -36.14 64.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.405 0.621 . . . . 0.0 109.677 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 16.0 mt -62.07 -43.46 97.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.724 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 5.0 m -63.52 -45.92 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.917 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 1.4 p -64.11 -43.25 95.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.338 0.59 . . . . 0.0 112.109 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -32.15 72.78 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.021 -0.424 . . . . 0.0 112.075 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 79.5 mt -69.46 -43.78 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 O-C-N 121.801 -0.562 . . . . 0.0 111.607 -178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 26.8 m -56.06 -38.09 51.76 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 O-C-N 121.361 -0.837 . . . . 0.0 111.426 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 . . . . . 0 CA--C 1.544 0.737 0 O-C-N 121.435 -0.791 . . . . 0.0 111.331 -179.192 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt 55.62 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.538 0.685 . . . . 0.0 110.341 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -175.03 169.54 3.34 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.85 -40.05 55.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -68.58 -36.28 78.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.407 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -81.13 -42.64 20.6 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.29 0.567 . . . . 0.0 110.343 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -64.34 -46.31 84.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.07 0.462 . . . . 0.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.96 76.75 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.42 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.4 m -59.72 -33.1 71.19 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.276 0.56 . . . . 0.0 110.833 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.53 -29.82 69.36 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.019 0.438 . . . . 0.0 111.092 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -60.67 -20.71 61.63 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.796 -0.565 . . . . 0.0 111.881 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -81.96 -23.99 35.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.08 0.467 . . . . 0.0 111.287 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -58.12 -43.43 87.22 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.496 0.665 . . . . 0.0 110.609 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.7 t80 56.78 37.5 28.85 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.45 0.643 . . . . 0.0 111.796 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.42 -68.23 0.08 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.633 -0.667 . . . . 0.0 112.026 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.87 -37.14 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-O 121.533 0.683 . . . . 0.0 111.532 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.1 m -51.88 -33.73 37.91 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -62.73 -49.68 74.08 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.338 0.589 . . . . 0.0 109.8 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.07 -43.96 90.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.633 0.73 . . . . 0.0 109.553 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -35.41 80.14 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.003 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -99.92 -12.47 19.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -100.61 -1.3 35.73 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.475 -0.766 . . . . 0.0 111.814 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . 0.453 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 7.9 pt -64.25 -36.75 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 O-C-N 121.918 -0.488 . . . . 0.0 110.822 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -47.28 69.84 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.376 0.608 . . . . 0.0 110.114 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.66 -26.18 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . 0.453 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -74.1 -32.4 63.2 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.038 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 20.1 mm -60.67 -48.74 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 121.153 0.501 . . . . 0.0 110.476 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 72.5 mt -67.19 -36.63 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 121.379 0.609 . . . . 0.0 109.669 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mt -58.69 -37.82 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.72 -41.38 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.03 -33.92 70.81 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 177.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -67.35 -38.29 84.59 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.886 0.85 . . . . 0.0 110.514 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.26 -42.01 90.16 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.463 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -64.95 -41.6 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.589 -0.695 . . . . 0.0 110.386 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.41 -18.36 50.2 Favored Glycine 0 CA--C 1.541 1.703 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.03 -38.24 87.9 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.789 0.804 . . . . 0.0 109.562 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . 0.423 ' HD2' ' N ' ' A' ' 696' ' ' ARG . 7.7 mpt_? -55.58 -28.71 56.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.585 0.754 . . . . 0.0 111.963 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.4 -41.59 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 O-C-N 121.472 -0.767 . . . . 0.0 109.094 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -30.25 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.251 -0.906 . . . . 0.0 110.078 177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.39 -28.65 55.4 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.588 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.1 72.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.97 -37.4 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 121.684 -0.635 . . . . 0.0 109.74 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.02 -44.02 97.6 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.128 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 2.1 p -62.69 -32.53 73.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.898 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.28 -43.82 96.83 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.385 1.088 . . . . 0.0 108.585 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.68 -41.92 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.431 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.29 -39.08 91.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.063 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -61.66 -48.68 79.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.104 0.954 . . . . 0.0 111.04 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -71.71 -44.39 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 122.29 1.043 . . . . 0.0 109.655 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -68.24 -20.57 64.82 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.871 -178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -97.11 -21.61 17.25 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.03 -1.044 . . . . 0.0 113.744 -177.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.06 69.98 0.72 Allowed Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.704 -0.622 . . . . 0.0 114.291 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 33.1 -134.73 0.03 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 97.3 p -62.81 159.33 45.75 Favored Pre-proline 0 C--N 1.353 0.752 0 O-C-N 121.166 -0.959 . . . . 0.0 112.01 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.72 105.74 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.189 0 C-N-CA 121.254 1.303 . . . . 0.0 111.504 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -101.34 -20.3 15.26 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 122.116 0.96 . . . . 0.0 109.41 -178.945 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 122.157 0.98 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -57.93 -25.33 60.76 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.536 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -6.84 0.13 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -177.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 9.9 ttm180 -59.71 -45.56 91.78 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -59.78 -32.13 70.32 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.662 0.744 . . . . 0.0 109.633 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -71.07 -46.09 62.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 121.487 -0.758 . . . . 0.0 111.075 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 97.3 p -58.27 -31.62 67.61 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.493 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.524 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.0 OUTLIER -65.93 -47.26 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 116.918 -1.515 . . . . 0.0 113.726 -179.2 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.78 -16.66 35.62 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 122.508 2.413 . . . . 0.0 108.597 178.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 714' ' ' PRO . 0.6 OUTLIER -56.03 -18.82 10.5 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 172.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 0.4 OUTLIER -55.83 -50.37 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 174.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -71.19 -23.1 61.97 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 122.584 1.183 . . . . 0.0 107.965 172.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.19 -18.33 20.28 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.401 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.5 p -56.49 -36.26 68.93 Favored 'General case' 0 C--N 1.344 0.361 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.15 -47.85 84.29 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 176.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.18 74.08 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.7 -45.3 92.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.453 0.644 . . . . 0.0 110.492 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.9 mm -61.62 -33.18 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.31 -30.65 69.69 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.731 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.44 -43.43 75.4 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.279 -0.888 . . . . 0.0 109.654 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -70.14 -44.76 68.21 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.315 0.578 . . . . 0.0 111.034 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.83 -35.66 81.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.279 0.561 . . . . 0.0 111.737 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.56 -35.22 65.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.943 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 13.1 t -69.64 -45.58 68.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.446 0.641 . . . . 0.0 111.094 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.76 -55.16 12.17 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.91 -49.68 4.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.537 0.684 . . . . 0.0 112.771 -179.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 12.0 tp 74.18 -62.2 0.47 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -137.96 134.86 35.42 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 58.67 174.51 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.07 0.462 . . . . 0.0 110.056 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.87 -27.04 14.09 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.042 -0.411 . . . . 0.0 111.266 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -52.94 -49.59 65.73 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.586 0.708 . . . . 0.0 110.493 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -56.55 -28.01 59.08 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.279 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -30.77 65.62 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.794 -0.566 . . . . 0.0 110.514 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -62.4 -31.84 72.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.521 0.676 . . . . 0.0 109.291 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.33 -47.82 84.38 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.793 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.89 -42.13 88.83 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.548 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.16 -40.13 84.65 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.879 -0.513 . . . . 0.0 112.306 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 60.6 mt -72.03 -37.73 69.67 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.39 -36.67 73.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.71 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.24 -46.38 77.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.82 -35.44 80.61 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.763 0.792 . . . . 0.0 110.293 178.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 23.7 tpt85 -67.09 -43.39 82.69 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.8 mt -63.59 -41.13 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.312 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.44 -38.67 80.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 121.499 -0.75 . . . . 0.0 110.272 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -61.25 -49.65 76.24 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 111.092 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.14 -44.12 69.53 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.202 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.61 0 CA-C-O 120.862 0.363 . . . . 0.0 111.826 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 52.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.954 0.883 . . . . 0.0 111.056 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -171.43 -176.68 1.9 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.469 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -43.84 68.67 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.812 0.815 . . . . 0.0 110.105 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -71.69 -31.48 66.82 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.355 -0.838 . . . . 0.0 112.537 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -44.94 21.2 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.316 0.579 . . . . 0.0 110.918 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -70.62 -42.1 71.38 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.369 0.604 . . . . 0.0 110.654 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.04 -20.92 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.33 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.0 p -65.47 -35.2 80.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.221 0.534 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.67 -31.46 69.57 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.272 0.558 . . . . 0.0 110.931 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -59.88 -24.46 64.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.096 0.474 . . . . 0.0 111.201 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -84.57 -27.72 27.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.264 0.554 . . . . 0.0 111.189 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -60.73 -53.15 60.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.482 0.658 . . . . 0.0 110.67 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.51 41.69 7.19 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.775 0.797 . . . . 0.0 111.538 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -156.68 -63.34 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.631 -0.668 . . . . 0.0 111.371 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.42 -37.33 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.803 -0.561 . . . . 0.0 111.286 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.7 m -52.36 -33.64 43.95 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.141 -0.349 . . . . 0.0 111.501 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . 0.404 ' OD1' ' CZ ' ' B' ' 681' ' ' TYR . 43.0 m-20 -62.12 -49.21 76.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.292 0.568 . . . . 0.0 110.166 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -65.62 -44.24 87.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 121.749 0.785 . . . . 0.0 109.814 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.78 -35.29 80.62 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -94.39 -34.81 12.62 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . 0.404 ' CZ ' ' OD1' ' B' ' 677' ' ' ASN . 20.7 m-30 -71.2 -20.95 62.21 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.928 -0.483 . . . . 0.0 111.77 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.5 pp -60.6 -36.43 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 121.9 -0.5 . . . . 0.0 110.224 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -54.52 -47.47 73.07 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.015 0.436 . . . . 0.0 110.875 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -69.04 -37.16 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -30.43 69.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.427 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 13.8 mm -60.62 -48.78 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 121.877 -0.515 . . . . 0.0 109.996 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 81.4 mt -61.71 -42.24 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.09 -37.74 69.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 68.5 t -56.22 -39.87 62.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.06 -27.16 68.41 Favored Glycine 0 CA--C 1.543 1.815 0 O-C-N 121.759 -0.588 . . . . 0.0 112.083 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.8 m -64.69 -45.89 84.69 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.422 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.41 -33.08 70.8 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -175.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.422 ' H ' HD11 ' B' ' 692' ' ' LEU . 0.0 OUTLIER -60.06 -41.5 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.23 -0.919 . . . . 0.0 109.278 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.2 -29.7 71.9 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.35 -37.62 81.24 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.943 0.877 . . . . 0.0 110.056 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 23.8 mmt180 -55.35 -27.42 47.18 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.206 1.188 . . . . 0.0 114.206 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 tp -58.0 -36.22 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 120.623 -1.298 . . . . 0.0 109.796 -176.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 5.0 p -66.67 -30.98 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.586 -0.696 . . . . 0.0 109.577 177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.3 m-85 -56.6 -30.59 63.41 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.52 76.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -40.81 88.63 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.3 tp -57.39 -37.97 73.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.123 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 48.0 m -64.12 -41.44 97.23 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.884 0.849 . . . . 0.0 109.885 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -43.58 98.41 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 122.162 0.982 . . . . 0.0 109.124 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.51 -40.83 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.165 -0.925 . . . . 0.0 108.878 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.69 -36.76 83.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.072 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -61.94 -47.21 85.9 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 122.263 1.03 . . . . 0.0 109.931 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 3.7 t -76.95 -45.55 30.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.727 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -37.96 65.11 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.368 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -22.09 14.38 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 110.08 146.5 11.16 Favored Glycine 0 CA--C 1.53 1.006 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -89.5 -60.55 1.91 Allowed 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.09 -0.653 . . . . 0.0 112.339 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.71 159.31 85.65 Favored Pre-proline 0 CA--C 1.538 0.513 0 O-C-N 121.516 -0.74 . . . . 0.0 109.33 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . 0.424 ' HA ' HD23 ' A' ' 748' ' ' LEU . 43.3 Cg_exo -27.47 139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.931 2.421 . . . . 0.0 114.26 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 8.7 tt -106.22 -20.46 13.39 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -178.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 122.396 1.093 . . . . 0.0 111.814 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 122.095 0.95 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -57.99 -26.64 62.61 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.262 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -13.58 1.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.811 -0.556 . . . . 0.0 112.264 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 51.4 mtm-85 -66.01 -46.29 78.47 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.498 -0.751 . . . . 0.0 110.915 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -30.97 67.57 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.728 -0.607 . . . . 0.0 109.588 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -48.87 51.82 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.416 0.627 . . . . 0.0 109.716 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.3 p -58.35 -44.43 88.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 122.111 -0.368 . . . . 0.0 110.643 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.66 -20.16 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.49 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -59.43 -33.69 71.57 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.67 -16.28 15.57 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 22.3 t -55.96 -53.8 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -72.04 -24.73 61.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.067 175.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.2 -20.6 36.32 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.236 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 2.3 m -58.99 -40.6 85.34 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 121.99 -0.712 . . . . 0.0 109.238 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.9 tp -65.7 -51.15 61.62 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.401 0.62 . . . . 0.0 109.378 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.65 -35.17 75.55 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.187 0.518 . . . . 0.0 111.345 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.43 -45.23 92.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.173 0.511 . . . . 0.0 110.891 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.02 -37.64 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -68.82 -30.34 68.87 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.301 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -55.25 -49.32 72.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.346 -0.846 . . . . 0.0 110.27 -178.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.42 -41.09 73.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.723 0.773 . . . . 0.0 110.567 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -36.23 83.45 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.198 -178.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.1 -50.28 9.24 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.256 0.55 . . . . 0.0 111.775 -178.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 61.6 m -61.81 -46.09 91.02 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.825 0.821 . . . . 0.0 111.116 -178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 8.4 tt -69.02 -53.67 19.26 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.2 m -97.73 -39.43 9.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -176.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 81.8 -167.59 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -38.37 -66.88 0.23 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 9.5 t -114.82 168.96 9.44 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.606 0.717 . . . . 0.0 111.713 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.92 -17.64 62.08 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.114 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -38.94 91.94 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -67.86 -29.91 69.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.744 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.79 -34.62 73.27 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 122.023 -0.423 . . . . 0.0 109.961 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 40.6 mmm-85 -61.19 -37.95 84.81 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.94 -43.64 74.66 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.283 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 9.3 mt -66.99 -38.21 85.61 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.752 0.787 . . . . 0.0 110.584 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.91 -38.62 86.57 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.022 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.42 -41.65 60.53 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.554 -0.716 . . . . 0.0 111.567 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 2.7 pp -68.19 -37.09 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 120.524 -0.471 . . . . 0.0 110.501 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.56 -45.5 78.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.655 -0.653 . . . . 0.0 109.328 -179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 29.7 p -64.46 -42.13 96.11 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 111.395 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -31.82 72.37 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 79.3 mt -61.07 -36.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 11.4 m -54.16 -37.4 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.413 -0.805 . . . . 0.0 110.043 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -54.31 -46.32 72.77 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.528 0.68 . . . . 0.0 110.505 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.23 -44.32 84.12 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.051 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 5.1 tp -71.77 -23.91 61.66 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.183 0.516 . . . . 0.0 111.129 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.86 -41.45 20.58 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.49 128.94 33.99 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.603 0.716 . . . . 0.0 110.462 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.071 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 121.592 0.71 . . . . 0.0 109.218 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 49.3 mt 59.96 113.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.46 0.648 . . . . 0.0 110.9 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -172.88 170.44 4.55 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.881 0.848 . . . . 0.0 110.524 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.49 -53.97 49.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.466 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -72.7 -15.74 61.68 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.775 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.06 -42.57 31.85 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.141 0.496 . . . . 0.0 110.896 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -69.2 -46.14 68.17 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.461 0.648 . . . . 0.0 110.949 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.66 -27.84 66.73 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.652 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 32.8 t -63.23 -26.49 68.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.138 0.494 . . . . 0.0 111.694 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -39.75 95.09 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.093 0.473 . . . . 0.0 111.569 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -60.44 -21.17 62.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.017 0.437 . . . . 0.0 111.642 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -79.13 -29.4 43.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.358 0.599 . . . . 0.0 111.093 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -58.45 -52.18 66.71 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.592 0.71 . . . . 0.0 110.51 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.6 t80 58.54 59.9 2.77 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.173 0.987 . . . . 0.0 111.068 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -176.0 -76.26 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.138 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.42 -36.76 77.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-O 121.593 0.711 . . . . 0.0 111.947 -178.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 8.0 m -51.41 -32.43 26.33 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -55.79 -43.51 76.89 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.708 -0.62 . . . . 0.0 110.986 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.52 96.79 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.512 0.673 . . . . 0.0 109.863 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.86 81.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.015 0.436 . . . . 0.0 111.792 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -88.33 -17.87 29.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -101.45 -20.34 15.17 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.687 -0.633 . . . . 0.0 112.121 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 pp -60.5 -36.68 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 O-C-N 121.784 -0.573 . . . . 0.0 110.904 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 5.6 ttt-85 -58.22 -46.74 85.34 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.717 0.77 . . . . 0.0 109.378 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 59.1 mt -71.15 -35.18 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-O 121.391 0.615 . . . . 0.0 109.673 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.52 -31.11 69.09 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.9 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 14.0 mm -61.05 -44.2 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 75.5 mt -62.25 -37.5 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 177.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.17 -40.95 85.01 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 86.7 t -54.97 -43.83 70.88 Favored 'Isoleucine or valine' 0 C--N 1.347 0.471 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.44 -39.2 43.87 Favored Glycine 0 CA--C 1.534 1.23 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.39 -38.88 85.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.307 1.051 . . . . 0.0 109.519 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -61.01 -46.26 91.47 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -65.75 -41.57 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.388 0.613 . . . . 0.0 110.157 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.8 -35.23 89.65 Favored Glycine 0 CA--C 1.535 1.319 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.0 tt -56.11 -37.62 69.66 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.086 0.946 . . . . 0.0 110.095 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -55.83 -28.17 55.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.5 tt -58.28 -35.59 54.21 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 121.158 -0.964 . . . . 0.0 111.082 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.28 -29.68 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -56.22 -31.14 63.24 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.728 -0.607 . . . . 0.0 110.735 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.07 -37.66 77.62 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.23 -40.91 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.54 -38.34 84.13 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.536 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 43.8 p -64.17 -36.49 84.22 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.286 0.565 . . . . 0.0 110.594 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -43.29 96.8 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 122.174 0.988 . . . . 0.0 108.533 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.94 -45.05 99.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.883 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -62.71 -36.77 84.05 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.407 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . 0.41 ' HG2' ' HB3' ' C' ' 712' ' ' TYR . 0.0 OUTLIER -62.13 -50.22 72.76 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.409 -0.807 . . . . 0.0 110.333 -177.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 -44.19 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -177.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.06 -44.58 65.49 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -104.1 -22.25 13.45 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.34 173.82 16.09 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . 0.41 ' HB3' ' HG2' ' C' ' 707' ' ' ARG . 14.3 p90 -134.49 -58.37 0.83 Allowed 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.6 -0.941 . . . . 0.0 112.628 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 53.1 p -64.19 154.46 82.64 Favored Pre-proline 0 C--N 1.343 0.307 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.574 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -36.41 96.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.806 0 C-N-CA 121.933 1.755 . . . . 0.0 111.554 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.8 tp -82.83 16.85 2.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.009 0.909 . . . . 0.0 109.728 179.134 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 121.824 0.821 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -40.79 95.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.094 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.72 -38.1 77.62 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.063 0.459 . . . . 0.0 111.821 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 11.3 ttm-85 -58.3 -36.51 73.44 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.099 -0.376 . . . . 0.0 111.191 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.52 -42.98 88.95 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -71.28 -44.17 65.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.71 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -27.97 58.98 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.36 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.15 -14.64 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -25.5 64.42 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 121.315 -0.865 . . . . 0.0 108.783 178.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -24.71 31.36 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.885 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.76 -54.03 30.78 Favored 'Isoleucine or valine' 0 C--N 1.349 0.577 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -72.54 -22.81 60.96 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.746 175.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.73 36.05 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.136 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.8 t -58.78 -40.87 85.25 Favored 'General case' 0 C--O 1.234 0.237 0 O-C-N 122.031 -0.688 . . . . 0.0 109.458 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.63 -48.96 67.81 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.371 0.605 . . . . 0.0 110.254 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.22 79.94 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 111.86 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.26 -45.16 91.95 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 110.74 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 51.1 mt -68.55 -36.36 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 121.502 0.668 . . . . 0.0 109.714 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.66 -30.36 69.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.34 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -55.44 -45.37 76.84 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.737 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -45.18 66.16 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 179.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.86 -45.96 69.69 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -67.3 -47.82 69.45 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.3 m -64.07 -45.15 90.02 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.901 0.858 . . . . 0.0 110.58 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.39 -53.31 24.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -98.23 -36.92 9.88 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.044 -1.035 . . . . 0.0 113.309 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' C' ' 766' ' ' PHE . 60.5 mt 65.0 177.68 0.19 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -177.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . 0.416 ' C ' ' O ' ' C' ' 765' ' ' LEU . 27.6 t80 -7.01 -66.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -178.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 54.7 p -130.38 172.38 11.93 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.171 0.51 . . . . 0.0 110.676 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.82 -15.73 63.77 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.792 0.33 . . . . 0.0 111.32 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -63.76 -42.16 97.86 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -64.07 -30.33 71.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.801 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.16 -32.3 70.92 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.953 -0.467 . . . . 0.0 110.015 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 17.3 ttt-85 -62.6 -38.82 91.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -67.7 -43.95 78.88 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.39 -37.47 83.54 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.71 -36.26 71.76 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.243 1.021 . . . . 0.0 108.707 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 8.6 tt -74.31 -41.33 61.33 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.704 0.764 . . . . 0.0 109.543 177.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 94.3 mt -60.91 -45.63 97.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.87 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 32.7 m -57.74 -39.19 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.57 -0.706 . . . . 0.0 111.102 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 7.2 m -63.22 -48.02 80.05 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.629 -0.67 . . . . 0.0 112.065 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -31.81 72.0 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.751 -0.593 . . . . 0.0 111.451 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.1 -40.22 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.368 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 20.3 m -53.02 -38.03 28.14 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 CA-C-N 120.185 1.357 . . . . 0.0 109.555 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.553 1.076 0 O-C-N 121.786 -0.571 . . . . 0.0 109.588 178.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 7.5 mp 61.57 116.34 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.469 0.652 . . . . 0.0 110.279 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -177.33 173.39 1.74 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.491 0.662 . . . . 0.0 110.086 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -51.68 -43.25 62.66 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.675 0.75 . . . . 0.0 111.118 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.31 -34.89 71.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.752 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.0 mmtt -72.03 -43.08 65.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.178 0.514 . . . . 0.0 111.301 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -67.07 -46.41 74.36 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.133 0.492 . . . . 0.0 110.596 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.44 90.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.376 0.608 . . . . 0.0 111.446 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.26 -33.25 69.18 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.248 0.547 . . . . 0.0 111.085 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.5 -25.57 68.08 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.168 -0.332 . . . . 0.0 111.799 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -61.3 -24.68 66.59 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.736 -0.603 . . . . 0.0 111.127 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -74.87 -31.38 61.6 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.334 0.588 . . . . 0.0 110.858 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 17.7 m95 -55.43 -50.46 69.74 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.683 0.754 . . . . 0.0 109.942 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 17.5 t80 58.7 12.34 2.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -124.98 -60.36 1.36 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.595 -0.691 . . . . 0.0 110.55 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -68.49 -36.66 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.485 0.66 . . . . 0.0 110.751 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.72 -33.87 36.49 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -175.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -63.7 -49.75 71.88 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.2 0.909 . . . . 0.0 110.253 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.6 t90 -65.59 -43.85 88.43 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.724 0.773 . . . . 0.0 109.525 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -35.71 81.87 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.8 t90 -101.64 -17.84 16.14 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -92.41 -8.21 45.45 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.432 -0.792 . . . . 0.0 112.053 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . 0.459 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 5.3 pt -61.06 -36.96 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.708 -0.62 . . . . 0.0 111.002 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.88 -47.44 71.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.946 0.403 . . . . 0.0 110.578 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.71 -33.45 52.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . 0.459 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.5 OUTLIER -59.81 -32.48 70.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.892 -179.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 11.0 mm -62.68 -43.25 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-O 121.526 0.679 . . . . 0.0 109.19 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 54.5 mt -66.65 -41.23 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.99 -38.27 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 78.7 t -56.99 -41.03 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.26 92.38 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -61.22 -38.9 88.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.318 1.056 . . . . 0.0 109.663 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.56 -46.1 91.46 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.791 -178.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -42.2 82.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.72 -36.54 92.87 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.8 tt -59.57 -41.88 91.2 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.835 0.826 . . . . 0.0 110.146 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -56.12 -28.55 58.3 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 49.1 mm -58.96 -35.68 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.52 -0.738 . . . . 0.0 110.831 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 4.1 p -53.98 -29.56 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 O-C-N 121.436 -0.79 . . . . 0.0 110.126 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -55.65 -30.85 61.71 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.843 -0.536 . . . . 0.0 110.41 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.72 77.44 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.21 -41.17 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.25 -36.98 76.45 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.746 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -41.66 98.28 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.358 0.599 . . . . 0.0 110.507 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.94 -40.91 95.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 122.026 0.917 . . . . 0.0 108.982 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -68.33 -41.82 83.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.914 0.864 . . . . 0.0 108.908 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -62.72 -45.01 94.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -61.08 -39.33 89.5 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.815 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.9 -44.48 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 122.246 1.022 . . . . 0.0 108.824 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -69.56 -16.81 63.49 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.595 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -93.84 7.75 43.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.494 -0.754 . . . . 0.0 112.644 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 71.83 42.7 52.57 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 110.121 -1.191 . . . . 0.0 110.121 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.55 -167.47 0.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.117 0.961 . . . . 0.0 109.935 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 16.8 p -62.72 160.35 36.66 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.671 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -24.34 100.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 123.86 3.04 . . . . 0.0 115.608 -178.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -109.55 -20.26 12.93 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.336 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 123.068 1.414 . . . . 0.0 109.863 -178.527 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 124.244 1.973 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.38 -25.24 59.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 113.64 -1.618 . . . . 0.0 112.486 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -54.21 -30.27 49.33 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -61.12 -42.68 98.98 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.406 -0.809 . . . . 0.0 110.775 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.93 -44.34 91.33 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.799 0.809 . . . . 0.0 110.02 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -36.89 72.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 745' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 748' ' ' LEU . 42.9 p -64.58 -28.17 69.45 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.786 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.449 ' HB ' HG21 ' C' ' 781' ' ' ILE . 0.9 OUTLIER -74.0 -47.1 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.695 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 747' ' ' ARG 0.28 9.4 ttt180 -71.9 0.73 8.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.763 -178.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 745' ' ' SER . 1.1 mm? -55.71 -16.61 4.48 Favored 'General case' 0 C--N 1.375 1.691 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 168.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.313 1.4 t -53.52 -54.77 16.64 Favored 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -73.52 -28.38 61.86 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.261 174.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.15 -20.49 35.57 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.528 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 81.2 p -58.23 -37.58 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.741 0.77 . . . . 0.0 109.187 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 38.1 tp -66.75 -51.14 59.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.185 0.517 . . . . 0.0 109.748 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.62 -35.07 79.3 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.226 0.536 . . . . 0.0 112.106 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 4.7 tt -59.18 -45.36 91.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.977 0.417 . . . . 0.0 111.411 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.4 mt -65.41 -31.88 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 121.335 0.588 . . . . 0.0 109.862 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.54 -30.74 68.63 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 122.049 -0.407 . . . . 0.0 111.799 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -55.67 -46.59 77.53 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.586 -0.696 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -43.32 70.09 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.461 0.648 . . . . 0.0 110.899 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 7.2 mt -60.99 -33.36 73.11 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.253 0.549 . . . . 0.0 111.463 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -82.33 -22.15 35.72 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.4 m -75.3 -46.68 31.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 120.959 -1.088 . . . . 0.0 112.299 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.65 -53.72 17.34 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -41.49 8.2 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 1.2 tt 92.1 -64.58 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.212 1.005 . . . . 0.0 111.787 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -151.2 25.08 0.72 Allowed 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.616 -0.677 . . . . 0.0 112.732 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 18.9 p -176.34 138.33 0.31 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.596 -0.69 . . . . 0.0 110.818 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.86 -5.34 25.12 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.861 0.362 . . . . 0.0 111.46 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -82.83 -38.6 22.82 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -61.31 -30.28 70.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.258 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.98 -33.42 71.92 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.043 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -57.03 -38.06 72.62 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.28 -38.13 78.2 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.639 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.19 -39.57 79.28 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 121.302 0.572 . . . . 0.0 109.805 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.65 -36.2 80.12 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.547 0.689 . . . . 0.0 110.783 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -45.36 52.5 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.962 0.41 . . . . 0.0 111.161 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -37.59 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 122.046 -0.409 . . . . 0.0 110.076 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . 0.43 ' HA ' HD11 ' A' ' 781' ' ' ILE . 13.4 p -61.64 -42.87 95.87 Favored 'Isoleucine or valine' 0 C--N 1.348 0.54 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 9.1 m -64.21 -35.84 82.13 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.306 0.574 . . . . 0.0 110.33 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.67 -37.65 88.14 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . 0.43 HD11 ' HA ' ' A' ' 778' ' ' VAL . 72.8 mt -54.01 -39.71 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 121.796 -0.565 . . . . 0.0 111.342 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 6.8 m -54.76 -35.75 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 120.933 0.397 . . . . 0.0 111.041 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -53.81 -51.12 64.51 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -176.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -32.98 70.55 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.47 0.538 0 O-C-N 121.751 -0.593 . . . . 0.0 111.94 -178.021 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.707 0.765 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 7.9 mp 45.5 90.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.556 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.76 52.42 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 122.112 0.958 . . . . 0.0 111.409 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 13.6 tp 77.77 -46.45 0.46 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.275 1.03 . . . . 0.0 110.151 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -34.29 72.12 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.438 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.64 -41.38 27.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.825 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -75.19 -42.4 55.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.04 0.448 . . . . 0.0 111.742 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.96 -29.69 64.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.393 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.5 m -62.43 -33.79 75.49 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.084 0.468 . . . . 0.0 111.195 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -27.19 68.93 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.027 0.441 . . . . 0.0 111.588 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.0 m95 -59.79 -32.62 70.79 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.156 0.503 . . . . 0.0 111.002 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -69.6 -27.86 65.46 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.105 0.479 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -67.86 -61.5 1.84 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.513 0.673 . . . . 0.0 110.336 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 11.9 t80 63.53 24.49 14.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -132.64 -82.15 0.49 Allowed 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.446 -0.784 . . . . 0.0 111.23 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.04 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.417 0.627 . . . . 0.0 110.611 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.0 m -50.73 -33.13 21.75 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.02 -0.425 . . . . 0.0 110.749 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 19.7 m-20 -56.48 -49.71 73.86 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -66.06 -43.57 87.04 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.81 0.814 . . . . 0.0 109.357 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.15 -35.15 71.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -105.55 -33.74 8.0 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -70.09 -8.71 51.66 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.418 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 0.2 OUTLIER -60.33 -35.8 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.506 -0.746 . . . . 0.0 111.456 179.542 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -47.3 68.74 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 122.118 -0.364 . . . . 0.0 110.907 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -68.31 -36.21 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.418 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.6 OUTLIER -59.82 -30.8 69.18 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.246 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 13.0 mm -60.91 -47.11 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.142 0.496 . . . . 0.0 109.762 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 70.3 mt -61.21 -39.44 82.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.72 -37.57 66.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 96.9 t -56.17 -41.93 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.52 -28.21 59.35 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.2 -37.44 87.49 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.996 0.518 . . . . 0.0 110.975 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.26 -45.83 87.12 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.224 0.535 . . . . 0.0 109.997 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.34 -40.25 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 O-C-N 122.174 -0.329 . . . . 0.0 110.945 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.44 96.0 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 109.906 -1.278 . . . . 0.0 109.906 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.62 -36.49 84.41 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.411 1.1 . . . . 0.0 110.705 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -28.57 49.85 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -176.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -35.57 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 120.839 -1.163 . . . . 0.0 110.092 -177.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -54.34 -30.3 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.263 -179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -56.7 -31.47 64.51 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 121.96 -0.462 . . . . 0.0 109.859 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.33 -38.38 80.19 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.02 -39.2 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tp -62.0 -36.38 81.34 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.326 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -62.1 -37.18 84.1 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 122.04 -0.413 . . . . 0.0 110.563 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -42.59 98.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 122.215 1.007 . . . . 0.0 108.349 177.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 90.4 t -64.04 -45.39 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.981 0.896 . . . . 0.0 109.05 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.81 -35.84 81.21 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.247 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.7 ttm105 -59.2 -50.47 73.89 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.822 -1.174 . . . . 0.0 110.393 -178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -78.59 -45.8 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.87 0.843 . . . . 0.0 112.66 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -74.1 -37.55 64.12 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.047 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -102.07 7.37 41.16 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 76.65 136.01 0.68 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -77.01 -49.63 14.96 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 122.233 -0.569 . . . . 0.0 110.005 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.02 157.43 33.72 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -36.31 108.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.102 1.868 . . . . 0.0 114.039 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 3.1 tp -80.11 13.93 2.09 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 27.8 p . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 -179.503 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 121.366 0.603 . . . . 0.0 111.514 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 -71.21 -26.84 63.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.897 -0.502 . . . . 0.0 111.05 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.46 -18.72 7.61 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.89 -0.506 . . . . 0.0 112.038 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -60.52 -39.68 88.66 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.917 -0.489 . . . . 0.0 111.094 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . 0.422 ' O ' ' HB ' ' B' ' 746' ' ' ILE . 1.0 OUTLIER -59.48 -34.75 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.88 -39.4 69.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.6 m -56.23 -22.79 31.72 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.577 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . 0.422 ' HB ' ' O ' ' B' ' 743' ' ' ASP . 0.6 OUTLIER -52.75 -30.53 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.163 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . 0.432 ' HA ' HD22 ' B' ' 750' ' ' ASN . 7.5 mtt180 -63.46 -14.13 47.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.418 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.13 -40.44 73.78 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -55.13 -54.12 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -176.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . 0.432 HD22 ' HA ' ' B' ' 747' ' ' ARG . 3.6 p30 -72.53 -16.11 61.77 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.439 0.638 . . . . 0.0 110.582 175.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -58.13 -21.41 46.34 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 4.4 m -64.48 -44.29 91.49 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.958 -0.731 . . . . 0.0 110.341 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.23 -45.98 71.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.056 0.932 . . . . 0.0 109.436 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.75 76.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.5 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.83 -46.3 88.0 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 121.839 -0.538 . . . . 0.0 110.956 -176.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 44.9 pt -76.2 -30.19 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 121.789 0.804 . . . . 0.0 110.575 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -69.25 -30.14 68.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.607 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.15 -49.46 77.16 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.593 -0.692 . . . . 0.0 109.148 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.37 -45.33 63.11 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.687 0.756 . . . . 0.0 111.205 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.25 -41.67 96.85 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.345 0.593 . . . . 0.0 112.279 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -82.1 -21.26 36.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 48.2 t -74.0 -45.65 48.59 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.448 -0.782 . . . . 0.0 112.151 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 5.9 mp -59.88 -54.94 40.32 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.09 -49.62 4.44 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.722 0.773 . . . . 0.0 112.53 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 72.15 120.85 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.656 0.741 . . . . 0.0 109.986 -178.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 15.1 t80 75.21 -69.19 0.18 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.322 0.649 . . . . 0.0 110.809 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 4.8 m -150.93 176.32 11.21 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.858 -0.526 . . . . 0.0 110.796 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.59 -172.31 0.16 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 78.35 -51.97 0.49 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.683 0.754 . . . . 0.0 108.985 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 15.1 tpt85 -56.62 -29.57 62.33 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.187 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -59.59 -31.99 69.97 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.937 -0.477 . . . . 0.0 109.874 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -57.18 -34.97 69.03 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.54 0.686 . . . . 0.0 109.181 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.01 -46.05 79.34 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.65 -42.69 88.96 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.524 0.678 . . . . 0.0 109.325 179.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.03 -39.0 80.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.317 0.58 . . . . 0.0 110.15 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.63 -42.6 77.82 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 122.129 -0.357 . . . . 0.0 111.276 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 52.2 mt -62.89 -41.48 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.93 -40.36 86.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.152 0.501 . . . . 0.0 110.097 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 9.8 m -62.93 -45.84 90.6 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.013 -0.429 . . . . 0.0 112.02 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.96 72.44 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.542 -0.724 . . . . 0.0 111.846 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 83.5 mt -68.54 -40.18 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.754 -0.591 . . . . 0.0 111.891 -178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 19.5 m -56.39 -38.11 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.362 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -63.25 -42.35 99.18 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.745 0.783 . . . . 0.0 109.742 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 22.8 tp -66.91 -41.57 86.9 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.8 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -35.19 80.25 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.102 0.477 . . . . 0.0 110.631 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -30.49 -51.93 0.21 Allowed Glycine 0 CA--C 1.539 1.535 0 C-N-CA 123.366 0.508 . . . . 0.0 113.04 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.59 85.87 2.44 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 122.214 1.007 . . . . 0.0 109.95 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.901 -1.047 . . . . 0.0 111.004 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 121.902 0.858 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 6.9 mp -114.59 151.53 33.29 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.322 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -175.46 174.8 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.278 0.561 . . . . 0.0 110.29 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.12 -57.1 7.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.681 0.753 . . . . 0.0 111.942 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.81 -20.7 66.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.265 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -79.18 -46.11 18.57 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.068 0.461 . . . . 0.0 110.962 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -58.5 -45.91 87.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.665 0.745 . . . . 0.0 110.288 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.83 -25.61 64.75 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.298 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 p -64.73 -35.64 81.71 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.276 0.56 . . . . 0.0 110.711 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 29.9 mt -59.91 -30.75 69.25 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.184 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.6 -25.5 64.67 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.963 -0.46 . . . . 0.0 110.857 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -77.79 -27.5 50.21 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.116 0.484 . . . . 0.0 111.277 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.34 -40.63 86.96 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.358 0.599 . . . . 0.0 110.515 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 55.63 32.43 19.23 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.299 0.571 . . . . 0.0 110.985 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -151.53 -69.12 0.17 Allowed 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.646 -0.659 . . . . 0.0 111.953 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 1.6 tp -64.91 -37.6 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 121.83 -0.544 . . . . 0.0 112.053 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.4 m -52.51 -43.12 64.89 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.864 -0.523 . . . . 0.0 111.6 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -57.66 -46.45 84.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.659 0.742 . . . . 0.0 110.13 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -65.17 -45.1 86.29 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.167 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 47.4 mt -65.75 -38.96 90.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.388 -0.82 . . . . 0.0 112.698 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -84.3 -42.04 16.22 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.891 -0.505 . . . . 0.0 112.171 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -65.81 -30.02 70.59 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.981 -0.449 . . . . 0.0 112.053 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.6 pp -62.26 -36.86 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 119.89 -0.724 . . . . 0.0 109.304 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -59.67 -45.2 92.79 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.1 mm -61.35 -42.81 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.339 1.066 . . . . 0.0 108.65 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.71 -27.4 66.41 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.031 -178.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 18.6 mm -60.27 -44.27 95.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.4 -37.74 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 38.4 mm -60.24 -39.29 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 84.5 t -55.69 -41.26 64.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -40.48 74.23 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.73 -38.23 83.25 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.824 0.821 . . . . 0.0 110.36 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.1 tp -59.42 -46.56 88.36 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.3 -41.55 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 121.747 -0.596 . . . . 0.0 109.913 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.02 -34.58 88.46 Favored Glycine 0 CA--C 1.533 1.207 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.75 -38.05 83.86 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.267 1.032 . . . . 0.0 110.214 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -56.37 -28.33 58.85 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.7 tt -58.79 -35.34 55.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 O-C-N 121.329 -0.857 . . . . 0.0 111.248 -176.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 12.9 p -53.72 -30.82 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.259 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -56.73 -31.58 64.68 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.832 -0.542 . . . . 0.0 110.27 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.94 88.63 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -68.92 -40.42 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.99 -37.56 71.82 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 40.0 m -62.39 -35.61 79.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.532 0.682 . . . . 0.0 109.436 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -41.85 99.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 122.343 1.068 . . . . 0.0 108.19 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.55 -45.36 97.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.458 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -62.79 -36.77 84.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.114 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ttm-85 -62.41 -50.45 71.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.507 -0.746 . . . . 0.0 111.645 -176.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -44.34 29.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.497 0.665 . . . . 0.0 111.714 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -74.31 -43.22 57.65 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.46 -22.06 14.13 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -174.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 135.68 -157.92 23.52 Favored Glycine 0 N--CA 1.478 1.441 0 O-C-N 121.317 -0.864 . . . . 0.0 111.675 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -147.47 -50.84 0.19 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.382 -1.069 . . . . 0.0 112.556 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 73.5 m -107.75 159.68 29.49 Favored Pre-proline 0 N--CA 1.463 0.183 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.33 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -32.97 97.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.226 1.951 . . . . 0.0 112.636 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' C' ' 716' ' ' SER . 6.1 tp -70.71 -20.0 62.7 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 716' ' ' SER . . . . . 0.496 ' C ' ' O ' ' C' ' 715' ' ' LEU . 2.3 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 122.09 0.947 . . . . 0.0 112.52 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 122.337 1.065 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -61.43 -26.4 67.84 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.934 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -21.3 13.6 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.89 -0.506 . . . . 0.0 111.808 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 31.3 mtm180 -74.28 -30.15 61.98 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.948 -0.47 . . . . 0.0 110.952 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -58.93 -44.27 91.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.564 0.697 . . . . 0.0 109.532 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -71.27 -40.37 70.99 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.213 0.53 . . . . 0.0 110.268 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 2.0 m -58.57 -41.97 86.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.843 0.354 . . . . 0.0 110.364 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 82.9 mt -58.66 -18.6 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 O-C-N 122.073 -0.392 . . . . 0.0 110.031 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -59.61 -33.3 71.3 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 5.2 tt -58.95 -18.78 36.86 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.579 179.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 93.9 t -55.69 -55.0 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -73.58 -20.19 60.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.017 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.66 -20.0 30.02 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.193 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 12.6 t -58.21 -37.85 75.62 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.69 -48.78 58.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.66 74.16 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.75 -45.55 91.88 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.346 0.593 . . . . 0.0 110.176 -178.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 42.5 mm -66.31 -36.37 77.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.44 0.638 . . . . 0.0 109.632 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.02 -34.12 74.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.03 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -56.49 -46.37 80.5 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.979 0.895 . . . . 0.0 109.16 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.4 -45.27 66.29 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.698 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -31.09 69.81 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -80.21 -49.8 11.14 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 11.6 t -65.82 -45.72 81.27 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -37.5 80.66 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 83.5 p -98.36 -49.03 4.83 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.621 0.724 . . . . 0.0 111.663 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 2.4 tt 68.4 55.85 0.5 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.454 1.121 . . . . 0.0 109.273 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 61.11 152.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.451 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.14 116.32 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.548 0.69 . . . . 0.0 111.709 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -26.63 68.84 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.734 -0.604 . . . . 0.0 110.82 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -65.52 -43.21 90.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.265 1.031 . . . . 0.0 108.293 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -64.72 -29.9 70.9 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.011 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.0 tt -59.75 -32.21 70.35 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.475 -0.766 . . . . 0.0 110.395 -178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -38.22 72.78 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.038 -0.414 . . . . 0.0 110.974 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -68.29 -33.9 75.18 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.286 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.25 -38.2 82.76 Favored 'General case' 0 C--N 1.353 0.746 0 CA-C-O 121.838 0.827 . . . . 0.0 110.113 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.17 -36.28 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.028 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -32.85 64.49 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.689 -0.632 . . . . 0.0 111.579 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 8.3 mt -64.87 -37.45 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.356 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 4.4 m -55.5 -39.72 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 122.075 -0.391 . . . . 0.0 111.751 -177.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 22.5 m -63.3 -48.21 79.04 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.774 -0.579 . . . . 0.0 110.679 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -31.56 71.98 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.486 0.66 . . . . 0.0 110.486 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.449 HG21 ' HB ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -58.2 -36.62 58.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.579 -179.268 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 39.9 t -52.74 -38.82 28.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.579 -0.701 . . . . 0.0 109.148 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 . . . . . 0 CA--C 1.543 0.681 0 O-C-N 121.463 -0.773 . . . . 0.0 111.197 177.613 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 tp . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.424 0.63 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 23.5 mt 54.37 64.02 1.96 Allowed 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.643 0.735 . . . . 0.0 109.49 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . 0.44 ' C ' ' H ' ' A' ' 664' ' ' ASP . 1.5 mm-40 -157.61 73.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 2.3 tm? 70.79 -35.4 0.33 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.981 0.912 . . . . 0.0 112.742 177.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 662' ' ' GLU . 11.7 t0 -91.56 -37.16 13.28 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.006 0.431 . . . . 0.0 111.758 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -81.38 -31.44 33.3 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.149 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.46 -39.9 62.23 Favored 'General case' 0 C--N 1.34 0.193 0 O-C-N 121.955 -0.466 . . . . 0.0 111.167 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -76.91 -36.27 56.76 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 57.4 p -58.13 -30.84 66.64 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.165 0.507 . . . . 0.0 110.844 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.93 -24.1 67.6 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -64.43 -31.13 72.21 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.83 -0.544 . . . . 0.0 111.107 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -69.45 -30.1 67.94 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.309 0.576 . . . . 0.0 111.032 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -57.48 -48.98 77.77 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.503 0.668 . . . . 0.0 110.374 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 t80 53.96 32.12 14.76 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.72 0.771 . . . . 0.0 110.829 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -146.79 -68.59 0.26 Allowed 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.702 -0.624 . . . . 0.0 111.715 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -39.83 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 CA-C-O 121.418 0.628 . . . . 0.0 111.953 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 17.4 m -52.81 -33.8 50.79 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -62.55 -50.15 72.48 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.874 -0.516 . . . . 0.0 111.783 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 -65.53 -45.58 82.89 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.649 -0.657 . . . . 0.0 110.379 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -35.1 78.87 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -86.29 -11.16 53.0 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.784 -0.573 . . . . 0.0 111.933 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -103.81 -21.87 13.61 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.17 -35.46 65.92 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 CA-C-N 120.729 1.604 . . . . 0.0 111.216 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 16.0 mmm-85 -52.95 -41.52 64.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.799 0.809 . . . . 0.0 109.618 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 88.4 mt -78.52 -40.91 24.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 CA-C-O 122.078 0.942 . . . . 0.0 109.305 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -27.61 68.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.442 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.75 -45.37 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.85 -37.31 71.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.99 -37.55 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.65 -42.7 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.74 -38.9 65.41 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.7 m -67.01 -38.85 86.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.697 0.76 . . . . 0.0 109.48 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -46.24 89.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.919 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -41.7 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.837 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.93 -31.25 80.18 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.03 -40.54 89.69 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.92 0.866 . . . . 0.0 110.031 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -55.53 -28.19 53.32 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.88 0.872 . . . . 0.0 112.112 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 45.3 mm -58.05 -35.33 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.52 -0.738 . . . . 0.0 109.624 -177.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 3.3 p -54.02 -28.65 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 121.784 -0.572 . . . . 0.0 110.221 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -54.55 -28.48 46.06 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.83 -0.544 . . . . 0.0 110.651 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.94 -37.42 71.49 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.4 m -67.29 -35.95 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -38.2 87.35 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.032 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 69.9 m -67.26 -40.92 86.27 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.248 0.546 . . . . 0.0 109.851 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 13.1 mt -64.91 -42.68 94.53 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-O 121.784 0.802 . . . . 0.0 109.331 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -41.49 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 2.2 m120 -60.93 -44.57 97.04 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -35.76 82.22 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.853 0.835 . . . . 0.0 110.575 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.0 t -75.59 -45.44 39.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.451 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -14.58 60.67 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . 0.419 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.8 OUTLIER -83.09 6.97 17.25 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.035 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.63 27.8 Favored Glycine 0 CA--C 1.539 1.57 0 O-C-N 122.024 -0.422 . . . . 0.0 113.17 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.6 -143.41 0.45 Allowed 'General case' 0 CA--C 1.56 1.351 0 O-C-N 121.738 -0.86 . . . . 0.0 110.435 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 81.7 p -62.12 159.7 36.32 Favored Pre-proline 0 C--N 1.351 0.667 0 O-C-N 121.293 -0.88 . . . . 0.0 110.682 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -41.57 104.56 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.585 1.523 . . . . 0.0 112.576 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -108.82 -20.57 13.02 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -177.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 121.536 0.684 . . . . 0.0 110.682 -179.442 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.311 1.053 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -57.93 -25.09 60.44 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.873 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.34 -9.86 0.33 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -175.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.65 -31.86 70.19 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.366 -0.834 . . . . 0.0 109.151 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -69.59 -45.06 69.5 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -71.11 -31.8 68.22 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.839 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 84.2 p -61.31 -42.57 98.89 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.416 ' O ' ' CG2' ' A' ' 749' ' ' VAL . 48.3 mt -57.65 -16.49 5.81 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -58.46 -25.28 62.09 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.96 -1.088 . . . . 0.0 108.87 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -14.76 21.32 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.416 ' CG2' ' O ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -54.33 -54.18 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.725 0 CA-C-N 121.4 1.909 . . . . 0.0 105.882 178.784 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -72.81 -20.43 61.14 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.074 -1.875 . . . . 0.0 110.993 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.96 38.5 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.04 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 7.2 m -61.46 -40.56 94.95 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.887 -0.772 . . . . 0.0 110.084 179.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.6 -50.87 40.4 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.56 0.695 . . . . 0.0 109.802 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.18 -34.83 78.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.176 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.5 -45.44 91.69 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.904 -0.497 . . . . 0.0 110.619 -177.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.0 mm -64.93 -34.8 72.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.725 0.774 . . . . 0.0 109.326 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -33.93 75.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.627 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -43.05 82.67 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.353 -0.842 . . . . 0.0 109.343 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -70.35 -44.33 68.38 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.664 0.745 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 12.9 mt -65.08 -32.55 74.31 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.651 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -82.39 -22.55 35.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -46.94 24.44 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.321 -0.862 . . . . 0.0 111.675 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.13 -53.4 20.38 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.514 -0.741 . . . . 0.0 111.899 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 10.0 p -97.79 -49.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.482 -0.761 . . . . 0.0 112.454 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 75.94 -7.64 1.77 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.984 0.514 . . . . 0.0 111.036 -178.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -174.95 121.42 0.22 Allowed 'General case' 0 C--N 1.347 0.493 0 O-C-N 121.346 -0.846 . . . . 0.0 110.985 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 67.1 m 48.96 -96.71 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.402 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -166.68 -21.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.243 -0.911 . . . . 0.0 112.252 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -52.43 -37.44 56.8 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.406 0.622 . . . . 0.0 110.385 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -70.31 -30.59 67.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.372 0.606 . . . . 0.0 111.029 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.61 -34.2 73.88 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.234 0.54 . . . . 0.0 109.926 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 -41.78 77.87 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -65.76 -34.48 78.27 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.24 -38.81 77.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.337 0.589 . . . . 0.0 110.489 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 6.6 tp -59.52 -36.96 77.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.235 0.54 . . . . 0.0 112.239 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.69 -42.45 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.631 -0.668 . . . . 0.0 111.634 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 29.2 pt -65.21 -35.93 76.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . 0.464 ' O ' ' HB ' ' A' ' 781' ' ' ILE . 17.5 m -54.55 -38.95 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.954 0.797 . . . . 0.0 110.171 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 17.8 p -63.07 -35.91 81.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 118.447 -1.301 . . . . 0.0 108.041 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -32.01 72.31 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.681 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . 0.464 ' HB ' ' O ' ' A' ' 778' ' ' VAL . 0.7 OUTLIER -57.54 -55.7 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.4 m -64.35 -38.89 83.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.594 0.711 . . . . 0.0 111.066 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.15 -41.64 97.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.602 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.91 -43.42 83.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.223 0.535 . . . . 0.0 111.231 -178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 120.966 0.412 . . . . 0.0 112.035 -179.315 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 58.05 106.31 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.315 0.579 . . . . 0.0 110.196 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.15 177.97 4.6 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.939 0.876 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 10.1 tt -46.19 -53.76 9.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.691 0.758 . . . . 0.0 111.48 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -65.41 -29.61 70.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.578 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -76.45 -44.4 35.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.913 0.387 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -59.08 -46.1 89.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.634 0.73 . . . . 0.0 110.085 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.08 -21.64 66.61 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.228 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 4.9 m -70.35 -36.25 74.09 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.822 -0.549 . . . . 0.0 111.217 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.74 -23.82 65.24 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.992 -0.443 . . . . 0.0 111.196 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -59.86 -23.02 63.07 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.764 -0.585 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -88.14 -27.73 21.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.123 0.487 . . . . 0.0 111.265 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -57.44 -50.87 71.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.528 0.68 . . . . 0.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.64 29.94 14.99 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.136 0.494 . . . . 0.0 111.269 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -144.11 -61.47 0.39 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.671 -0.643 . . . . 0.0 111.075 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.9 tp -67.92 -37.78 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 121.323 0.582 . . . . 0.0 110.33 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.8 m -52.98 -34.55 56.56 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.758 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -69.16 -50.47 47.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.886 -0.509 . . . . 0.0 111.368 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.74 -42.17 95.4 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.0 tp -65.97 -35.74 81.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.94 0.4 . . . . 0.0 110.859 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -101.27 6.56 42.92 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.58 -21.15 9.29 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 121.71 -0.619 . . . . 0.0 110.471 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 tp -62.16 -35.53 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.771 0.796 . . . . 0.0 109.982 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -53.21 -47.36 69.0 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.622 -0.674 . . . . 0.0 109.972 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.21 -37.91 76.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 122.246 1.022 . . . . 0.0 108.394 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.73 -33.89 72.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.674 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.49 -41.98 89.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 86.2 mt -62.41 -36.95 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.15 -37.54 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.12 -38.79 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 O-C-N 121.723 -0.611 . . . . 0.0 109.447 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.64 -27.15 57.61 Favored Glycine 0 CA--C 1.546 1.995 0 O-C-N 121.902 -0.499 . . . . 0.0 112.078 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.7 m -60.77 -47.12 87.76 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -32.59 70.65 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.528 -0.733 . . . . 0.0 111.482 -178.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -57.37 -41.66 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 O-C-N 121.605 -0.684 . . . . 0.0 109.662 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.94 -32.17 83.34 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.84 -37.08 63.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.3 1.048 . . . . 0.0 109.345 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.58 -28.28 54.12 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.692 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 79.2 mt -58.77 -36.21 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 O-C-N 121.423 -0.798 . . . . 0.0 108.914 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -30.29 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 O-C-N 121.674 -0.641 . . . . 0.0 110.123 177.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -56.36 -31.01 63.38 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 121.828 -0.545 . . . . 0.0 109.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.89 -37.57 76.89 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.86 -40.59 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.167 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 176.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.3 tp -55.6 -37.21 67.82 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.975 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.5 m -62.37 -40.77 97.51 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.178 0.513 . . . . 0.0 110.821 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.78 -41.05 94.79 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.069 0.938 . . . . 0.0 109.265 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.68 -43.57 80.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.556 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . 0.494 ' O ' ' HB2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.77 -36.41 82.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.078 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -67.19 -47.75 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.151 -0.968 . . . . 0.0 110.375 -178.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.6 t -77.12 -46.29 28.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -73.8 -43.17 59.63 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.494 ' HB2' ' O ' ' B' ' 706' ' ' ASN . 31.5 mt-30 -102.01 -21.58 14.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -175.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 109.43 136.32 7.53 Favored Glycine 0 CA--C 1.534 1.235 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -75.4 -67.89 0.61 Allowed 'General case' 0 CA--C 1.557 1.24 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 1.7 p -65.54 159.6 66.42 Favored Pre-proline 0 N--CA 1.47 0.535 0 O-C-N 120.628 -1.295 . . . . 0.0 110.516 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -37.57 133.11 0.62 Allowed 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.996 1.798 . . . . 0.0 111.847 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.503 ' O ' ' C ' ' B' ' 716' ' ' SER . 2.0 mm? -94.16 -20.35 19.95 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.503 ' C ' ' O ' ' B' ' 715' ' ' LEU . 97.3 p . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 122.279 1.037 . . . . 0.0 112.819 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 121.47 0.653 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -71.03 -26.61 63.18 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.298 0.57 . . . . 0.0 111.284 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -56.23 -7.03 0.31 Allowed 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . 0.416 ' O ' HG13 ' B' ' 746' ' ' ILE . 3.6 ttm180 -55.73 -38.99 70.51 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.515 -0.741 . . . . 0.0 110.912 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -58.54 -43.94 89.45 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.339 0.59 . . . . 0.0 109.664 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -71.42 -39.78 70.87 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.141 0.496 . . . . 0.0 110.468 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.84 -23.76 46.32 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . 0.461 HG22 HG13 ' A' ' 781' ' ' ILE . 48.6 mt -52.43 -32.47 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.36 67.57 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.165 0.507 . . . . 0.0 110.452 179.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 45.4 mt -56.24 -35.7 67.67 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.497 0.555 . . . . 0.0 112.497 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.48 -54.11 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -72.46 -18.77 61.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.668 0.746 . . . . 0.0 110.073 175.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.4 37.26 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.377 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 83.8 p -59.21 -39.65 83.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 117.787 0.793 . . . . 0.0 110.052 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.0 tp -69.66 -51.17 37.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.8 0.81 . . . . 0.0 109.649 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.13 73.27 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.408 0.623 . . . . 0.0 111.366 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.76 -45.2 92.97 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 120.976 0.417 . . . . 0.0 110.787 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 53.7 mt -70.4 -33.7 55.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.5 0.667 . . . . 0.0 109.55 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.1 -30.28 68.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.754 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -55.61 -47.97 75.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.409 -0.807 . . . . 0.0 110.086 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -70.73 -45.25 65.22 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.1 mt -69.23 -46.28 67.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.653 0.74 . . . . 0.0 112.535 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -69.06 -40.12 78.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.682 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 15.4 t -63.92 -45.1 90.77 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.911 0.862 . . . . 0.0 110.599 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.83 -51.84 62.88 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.872 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.1 -49.23 5.07 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.878 -0.514 . . . . 0.0 111.922 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 69.45 93.54 0.08 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 122.22 1.009 . . . . 0.0 109.81 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 58.6 t80 56.54 -88.51 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.915 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.2 m -67.96 134.76 51.31 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.283 -0.886 . . . . 0.0 111.246 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.6 -33.95 69.46 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.001 0.429 . . . . 0.0 109.981 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -54.46 -38.49 66.43 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.154 0.978 . . . . 0.0 108.956 178.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.85 -29.6 60.12 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.452 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.25 -41.28 88.39 Favored 'General case' 0 C--N 1.343 0.296 0 O-C-N 121.794 -0.566 . . . . 0.0 109.841 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -59.95 -39.47 85.67 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -64.22 -45.65 87.31 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.235 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.6 -37.8 85.65 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 121.835 0.826 . . . . 0.0 110.262 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -36.65 83.92 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.646 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.67 -42.21 61.64 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.848 -0.533 . . . . 0.0 111.996 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.89 -37.44 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 121.634 -0.666 . . . . 0.0 110.468 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 13.1 p -63.32 -44.99 99.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.886 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 7.2 t -64.06 -35.72 81.67 Favored 'General case' 0 C--N 1.351 0.642 0 O-C-N 121.577 -0.702 . . . . 0.0 111.125 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -31.47 71.94 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.983 -0.448 . . . . 0.0 111.622 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 76.5 mt -67.88 -36.78 76.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 O-C-N 121.759 -0.588 . . . . 0.0 110.907 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.9 m -61.07 -39.0 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.852 -0.53 . . . . 0.0 111.984 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.4 -41.58 93.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.628 -0.67 . . . . 0.0 111.043 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.0 -42.17 99.78 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.619 0.723 . . . . 0.0 110.174 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 15.0 tp -82.36 -17.38 45.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.413 0.625 . . . . 0.0 111.624 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.37 -46.09 22.22 Favored Glycine 0 CA--C 1.531 1.074 0 O-C-N 121.797 -0.564 . . . . 0.0 112.16 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 95.5 5.29 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.488 0.661 . . . . 0.0 110.524 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.127 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.0 pp . . . . . 0 N--CA 1.496 1.827 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.0 143.28 50.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.267 0.556 . . . . 0.0 110.63 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -172.44 176.44 3.3 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.086 0.469 . . . . 0.0 110.05 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 20.7 tp -54.59 -44.0 72.64 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.767 0.794 . . . . 0.0 109.957 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.88 -33.52 76.22 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.778 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -79.19 -40.32 31.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.185 0.517 . . . . 0.0 110.736 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -70.78 -46.33 63.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 110.318 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.72 -22.26 66.59 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.442 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 36.3 t -68.1 -35.56 78.36 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.1 0.476 . . . . 0.0 111.441 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -34.47 73.35 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.117 0.484 . . . . 0.0 111.197 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 64.9 m95 -59.83 -27.93 67.04 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.117 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -77.73 -20.1 54.07 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.081 -0.387 . . . . 0.0 112.033 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -67.46 -45.07 77.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.673 0.749 . . . . 0.0 110.348 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 53.89 29.26 9.6 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.028 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.05 -75.8 0.24 Allowed 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.49 -0.756 . . . . 0.0 112.497 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -68.23 -36.67 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.62 -0.675 . . . . 0.0 111.221 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 25.3 m -51.62 -33.09 31.58 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.16 -0.337 . . . . 0.0 110.963 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -56.33 -47.89 77.85 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -43.43 92.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.87 -40.14 83.49 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -97.71 -40.39 8.6 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -69.18 -19.79 63.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.704 -0.623 . . . . 0.0 112.015 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -60.63 -36.7 72.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 1.6 ttt-85 -53.69 -45.21 70.29 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 121.861 0.839 . . . . 0.0 109.023 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.3 mm -62.38 -43.13 97.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 122.4 1.095 . . . . 0.0 108.898 177.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.47 -27.59 67.67 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.125 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.11 -46.48 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.974 -0.454 . . . . 0.0 109.889 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.02 -41.4 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -59.79 -37.59 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.951 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 79.6 t -54.78 -45.32 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.33 -38.76 62.96 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -37.93 84.65 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 122.09 0.948 . . . . 0.0 109.824 177.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.23 -46.29 88.87 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 113.166 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -61.3 -41.82 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.401 -0.812 . . . . 0.0 109.415 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.95 73.15 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.87 -37.66 66.55 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.559 -0.965 . . . . 0.0 110.196 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.91 -28.68 57.89 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 -177.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -36.85 62.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-N 121.338 1.881 . . . . 0.0 111.183 -175.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -62.55 -30.26 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.448 -0.782 . . . . 0.0 111.014 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -56.29 -31.12 63.36 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.75 -0.594 . . . . 0.0 110.04 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.18 -37.79 78.24 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -43.64 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tp -61.24 -37.71 84.06 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.209 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 61.9 m -62.52 -36.23 81.94 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.374 0.607 . . . . 0.0 110.371 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -47.01 85.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.483 1.135 . . . . 0.0 108.494 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.72 -44.26 98.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.783 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -62.57 -35.79 80.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.281 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -61.32 -50.28 73.59 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.473 -0.767 . . . . 0.0 110.655 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -77.33 -45.02 30.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.824 0.821 . . . . 0.0 111.782 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -73.83 -33.37 64.12 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -102.17 -15.49 16.65 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -177.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 91.83 133.73 6.12 Favored Glycine 0 CA--C 1.542 1.751 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -87.7 -36.72 17.23 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.764 -0.845 . . . . 0.0 113.102 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.53 149.35 35.65 Favored Pre-proline 0 N--CA 1.469 0.483 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.961 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -36.71 92.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.501 2.134 . . . . 0.0 112.704 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.97 11.03 1.94 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.492 0.663 . . . . 0.0 110.903 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -72.67 -38.31 67.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.328 0.585 . . . . 0.0 111.528 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.57 -7.49 53.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.87 -35.34 80.38 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.695 -0.628 . . . . 0.0 111.411 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -58.04 -41.19 82.74 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 109.786 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.4 68.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-O 121.214 0.531 . . . . 0.0 110.496 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 83.8 p -67.04 -43.09 83.64 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.637 -0.665 . . . . 0.0 110.178 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.43 -23.9 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.945 178.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . 0.436 ' HA ' HD22 ' C' ' 750' ' ' ASN . 6.9 mtt180 -60.01 -15.64 24.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.885 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -55.38 -31.77 62.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.972 -0.455 . . . . 0.0 110.949 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.7 t -55.73 -54.9 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . 0.436 HD22 ' HA ' ' C' ' 747' ' ' ARG . 1.1 p30 -72.39 -23.63 61.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.766 0.793 . . . . 0.0 109.761 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.75 -21.76 44.74 Favored Glycine 0 C--N 1.342 0.899 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.012 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 19.3 m -63.07 -42.24 99.62 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.943 -0.739 . . . . 0.0 109.894 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.7 tp -69.32 -44.86 70.85 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.422 0.63 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.78 -35.63 79.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.872 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.33 -45.3 95.02 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.216 0.531 . . . . 0.0 111.241 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 44.7 mm -71.67 -40.99 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.118 0.485 . . . . 0.0 110.38 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.56 -41.11 76.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -55.84 -35.89 66.92 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.346 -0.847 . . . . 0.0 110.54 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -70.37 -45.47 66.0 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.762 0.791 . . . . 0.0 111.156 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 20.8 mt -69.61 -46.07 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.676 0.75 . . . . 0.0 112.249 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.81 -27.5 65.92 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.543 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.9 m -63.96 -43.96 94.22 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.447 0.641 . . . . 0.0 111.173 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.73 -54.66 14.76 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 3.0 p -97.86 -18.26 18.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 49.67 78.86 0.09 Allowed 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.393 -0.817 . . . . 0.0 109.744 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 69.9 t80 65.9 125.0 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.234 1.016 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 23.06 88.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 178.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 22.63 -146.72 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.759 1.223 . . . . 0.0 114.028 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 74.26 -64.56 0.38 Allowed 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.201 -0.937 . . . . 0.0 109.398 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.26 69.77 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.098 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.48 -36.93 76.96 Favored 'General case' 0 C--N 1.348 0.543 0 O-C-N 121.803 -0.561 . . . . 0.0 109.731 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -42.96 82.17 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' C' ' 776' ' ' LEU . 23.6 m-20 -69.38 -34.4 74.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.556 176.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.08 -41.2 96.21 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.749 -0.594 . . . . 0.0 110.868 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.45 -38.3 83.74 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 773' ' ' ASP . 3.3 pp -74.01 -28.45 61.45 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.656 -0.652 . . . . 0.0 111.822 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.26 -39.14 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 O-C-N 121.467 -0.77 . . . . 0.0 110.682 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 12.3 m -66.36 -46.35 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.877 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 9.8 t -64.21 -37.5 87.71 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.974 -0.454 . . . . 0.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.6 72.59 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.148 -0.345 . . . . 0.0 111.567 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 8.9 tt -55.03 -39.95 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.546 -0.721 . . . . 0.0 111.233 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 20.3 m -60.16 -38.29 76.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.276 -0.569 . . . . 0.0 111.917 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 CA--C 1.544 0.723 0 O-C-N 121.708 -0.62 . . . . 0.0 111.531 -178.727 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.5 tp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.755 0.788 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 76.0 mt 52.75 81.03 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.046 0.927 . . . . 0.0 111.209 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.75 177.82 8.44 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -34.38 61.22 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.253 0.549 . . . . 0.0 110.15 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -75.79 -35.54 60.04 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -80.1 -41.2 26.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.259 0.552 . . . . 0.0 110.676 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -67.96 -43.62 78.62 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.298 0.57 . . . . 0.0 110.281 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.54 -29.52 63.65 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.722 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 36.7 t -69.77 -30.56 68.16 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 110.745 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 17.8 tp -61.02 -31.5 71.13 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.843 0.354 . . . . 0.0 111.173 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.58 -18.3 39.98 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.921 -0.487 . . . . 0.0 111.702 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -84.02 -16.08 45.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.921 -0.487 . . . . 0.0 111.807 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.6 -50.22 74.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.341 0.591 . . . . 0.0 110.88 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 55.3 t80 56.55 44.42 24.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.005 0.907 . . . . 0.0 110.982 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -153.59 -80.61 0.09 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.8 -0.562 . . . . 0.0 110.561 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 11.2 tt -68.13 -35.71 72.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.841 -0.537 . . . . 0.0 111.973 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -50.22 -33.34 19.13 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -174.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -63.26 -50.42 70.23 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.331 0.969 . . . . 0.0 109.001 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . 0.411 ' CD1' ' C ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -66.07 -44.37 84.72 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.577 0.704 . . . . 0.0 110.123 177.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.67 -37.08 86.0 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -92.11 -44.51 8.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -73.38 -0.82 15.89 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -36.37 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 121.296 -0.878 . . . . 0.0 109.622 178.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.77 -47.58 70.57 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.96 0.41 . . . . 0.0 110.874 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.43 -31.98 53.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -33.61 76.19 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 8.9 mm -60.83 -49.51 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 109.991 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.0 mt -61.48 -38.5 80.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.09 -37.16 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.245 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 74.9 t -54.2 -39.65 43.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.7 -41.73 97.6 Favored Glycine 0 CA--C 1.534 1.24 0 N-CA-C 108.961 -1.655 . . . . 0.0 108.961 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -61.77 -37.9 86.04 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.777 0.798 . . . . 0.0 109.766 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.88 -46.09 88.65 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.879 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -40.1 81.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.538 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -26.73 64.07 Favored Glycine 0 CA--C 1.54 1.652 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.41 -37.33 85.39 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.691 1.234 . . . . 0.0 109.332 177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -55.9 -28.31 56.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.019 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -37.12 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.03 -1.043 . . . . 0.0 109.869 -177.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.1 p -67.41 -30.57 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 121.547 -0.721 . . . . 0.0 109.952 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -28.79 56.94 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.232 0.539 . . . . 0.0 109.713 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.06 72.01 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.9 m -61.01 -35.93 68.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -38.0 72.81 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.0 m -64.18 -36.7 84.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.748 0.785 . . . . 0.0 109.707 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -44.11 97.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 122.495 1.14 . . . . 0.0 108.636 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.45 -42.03 92.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.484 178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -62.61 -37.08 84.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.574 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 21.4 ttm105 -61.59 -46.93 87.77 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.096 0.951 . . . . 0.0 110.334 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.3 t -75.77 -44.04 39.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.15 0.976 . . . . 0.0 109.833 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.88 -14.89 61.58 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -20.69 18.2 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.297 -0.877 . . . . 0.0 111.962 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.9 24.96 7.03 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . 0.416 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 59.07 -103.55 0.17 Allowed 'General case' 0 CA--C 1.562 1.406 0 O-C-N 121.956 -0.732 . . . . 0.0 111.559 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 713' ' ' SER . . . . . 0.416 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 2.2 p -79.39 159.52 72.2 Favored Pre-proline 0 C--N 1.349 0.558 0 O-C-N 120.931 -1.106 . . . . 0.0 110.013 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -41.72 110.82 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.574 1.516 . . . . 0.0 112.514 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.94 -18.97 13.56 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 122.072 -0.392 . . . . 0.0 111.797 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.546 0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 111.044 -179.802 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.77 0.795 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -26.52 62.38 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.69 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -13.48 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -73.79 -46.82 43.08 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.358 -0.839 . . . . 0.0 110.148 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . 0.421 ' HA ' HG23 ' C' ' 781' ' ' ILE . 1.3 p30 -62.79 -34.68 77.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 122.52 1.152 . . . . 0.0 109.645 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -37.87 70.34 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.645 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.3 t -70.02 -39.7 75.65 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.626 -0.671 . . . . 0.0 112.654 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.484 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.0 OUTLIER -66.36 -41.26 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-O 116.367 -1.778 . . . . 0.0 115.28 -176.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 747' ' ' ARG . 1.6 tmt_? -78.37 -11.51 59.95 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 123.568 2.895 . . . . 0.0 109.212 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -55.78 -20.54 15.32 Favored 'General case' 0 C--N 1.375 1.698 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 172.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.484 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.8 p -54.67 -50.41 60.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 177.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.405 ' HB2' ' HD3' ' A' ' 747' ' ' ARG . 1.3 m-80 -71.99 -28.17 63.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.4 -18.65 22.92 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.409 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 77.6 p -56.63 -36.77 69.85 Favored 'General case' 0 C--N 1.347 0.458 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 33.7 tp -61.53 -47.96 83.19 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.74 -34.59 71.54 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.768 178.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.01 -44.68 91.72 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.725 -0.61 . . . . 0.0 111.38 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.36 -32.63 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.43 -30.67 68.65 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.019 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.433 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 4.4 m-20 -58.02 -46.99 84.4 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.94 0.876 . . . . 0.0 108.814 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.71 -42.24 70.86 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.505 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 19.3 mt -68.25 -33.39 74.3 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -70.65 -27.43 64.03 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 2.8 m -75.82 -45.35 36.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.544 0.688 . . . . 0.0 110.819 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.5 -56.79 7.16 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.41 -49.53 4.21 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.085 0.945 . . . . 0.0 112.301 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 2.9 tm? 91.32 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.354 1.462 . . . . 0.0 110.626 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -114.11 -68.07 0.95 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.648 -0.657 . . . . 0.0 111.266 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 24.8 p -91.45 158.8 16.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -78.31 -18.26 55.46 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.122 0.487 . . . . 0.0 111.015 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -72.36 -35.3 68.48 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.589 0.709 . . . . 0.0 109.345 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -57.85 -30.02 65.45 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.243 0.544 . . . . 0.0 110.68 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -34.82 73.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -56.84 -37.58 71.47 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.599 0.714 . . . . 0.0 109.582 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.31 -48.58 72.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.83 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.52 -38.48 84.53 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.653 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.59 -36.97 74.83 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.4 -0.813 . . . . 0.0 110.641 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.23 -45.31 48.91 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.99 -0.444 . . . . 0.0 112.069 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.31 -37.25 79.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.685 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 38.5 t -56.28 -46.79 81.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 68.2 p -64.13 -35.37 80.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.606 0.717 . . . . 0.0 109.854 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -65.3 -38.4 90.08 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.129 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 78.4 mt -59.29 -37.07 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 O-C-N 122.078 -0.389 . . . . 0.0 111.399 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 5.7 m -54.39 -38.34 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 121.331 -0.856 . . . . 0.0 110.431 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -64.57 -42.51 95.61 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.399 0.619 . . . . 0.0 110.768 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.22 -43.94 69.63 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.399 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.633 0 O-C-N 121.861 -0.525 . . . . 0.0 111.057 -179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.4 mm? 60.25 110.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.342 0.591 . . . . 0.0 110.239 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -177.2 169.4 2.29 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.21 -38.6 53.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.402 0.62 . . . . 0.0 110.552 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -70.96 -37.16 72.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.336 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -70.31 -47.85 59.3 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.364 0.602 . . . . 0.0 110.775 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -60.22 -45.4 93.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.435 0.636 . . . . 0.0 110.182 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.8 -25.68 65.71 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.311 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.29 -37.75 88.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.216 0.531 . . . . 0.0 111.136 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 45.0 mt -60.13 -30.28 69.18 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.015 0.436 . . . . 0.0 111.718 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -59.56 -25.15 64.31 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.211 0.529 . . . . 0.0 110.695 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -81.14 -22.03 39.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.091 0.472 . . . . 0.0 111.328 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -70.01 -49.69 48.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.649 0.737 . . . . 0.0 110.702 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.6 t80 59.78 49.69 7.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.02 0.914 . . . . 0.0 111.031 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -158.21 -70.37 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.867 -0.52 . . . . 0.0 110.855 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.19 -37.18 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.129 0.49 . . . . 0.0 110.912 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.34 -33.74 44.13 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -65.28 -50.86 64.13 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 121.495 -0.753 . . . . 0.0 110.753 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -65.84 -44.03 86.75 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.854 0.835 . . . . 0.0 109.094 177.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.65 -35.73 81.5 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.25 -28.1 12.83 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -82.6 -6.04 59.13 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.432 -0.792 . . . . 0.0 112.155 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.462 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 3.3 pt -60.88 -36.74 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.782 -0.574 . . . . 0.0 111.038 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.39 -47.08 69.82 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.075 0.464 . . . . 0.0 110.291 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.99 -34.0 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.462 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.4 OUTLIER -60.56 -27.62 67.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.38 179.606 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 22.4 mm -60.75 -45.53 97.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.256 0.55 . . . . 0.0 109.537 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 71.6 mt -62.63 -40.87 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.6 mt -58.61 -37.53 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 62.8 t -57.77 -43.35 83.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.63 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.71 -26.71 47.4 Favored Glycine 0 CA--C 1.544 1.845 0 O-C-N 121.579 -0.701 . . . . 0.0 111.926 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 18.6 m -60.52 -45.82 92.41 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -32.61 70.58 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 119.674 1.124 . . . . 0.0 111.586 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.42 -44.98 85.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.579 -0.701 . . . . 0.0 109.628 -178.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.09 67.66 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -37.4 80.04 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.018 0.913 . . . . 0.0 110.424 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.46 ' HD2' ' N ' ' B' ' 696' ' ' ARG . 8.4 mpt_? -54.85 -28.48 50.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.077 0.951 . . . . 0.0 113.259 -178.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -36.4 62.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 O-C-N 120.953 -1.092 . . . . 0.0 109.204 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -30.22 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 121.499 -0.751 . . . . 0.0 110.413 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.29 -31.09 63.33 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 121.861 -0.524 . . . . 0.0 109.861 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.67 77.23 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -42.15 89.63 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 176.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.3 tp -58.64 -38.76 78.8 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.423 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -62.92 -35.17 79.21 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.375 0.607 . . . . 0.0 110.414 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -42.32 95.0 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 122.191 0.996 . . . . 0.0 108.965 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 72.0 t -66.77 -45.17 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 122.192 0.996 . . . . 0.0 108.783 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.4 m-80 -62.86 -36.43 83.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -69.0 -50.13 51.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.741 0.781 . . . . 0.0 111.151 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . 0.524 HG22 ' HA ' ' C' ' 713' ' ' SER . 1.0 OUTLIER -77.95 -44.67 28.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.148 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -59.75 -45.69 91.43 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' B' ' 706' ' ' ASN . 3.8 pt20 -105.08 -24.11 12.83 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 140.41 164.96 10.11 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -98.5 -65.49 0.96 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.899 -0.765 . . . . 0.0 111.511 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 38.6 p -72.56 159.47 85.28 Favored Pre-proline 0 CA--C 1.532 0.282 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.299 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -34.59 125.02 0.19 Allowed 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.269 1.979 . . . . 0.0 113.352 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' B' ' 716' ' ' SER . 7.2 tt -87.5 -20.4 26.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.42 ' C ' ' O ' ' B' ' 715' ' ' LEU . 27.2 t . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 122.131 0.967 . . . . 0.0 113.175 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.16 0.981 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -57.93 -26.33 62.1 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.401 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.4 -8.67 0.36 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 4.8 ptt-85 -78.18 -26.65 47.73 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.296 -0.877 . . . . 0.0 111.453 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -58.14 -45.89 86.6 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.97 -0.456 . . . . 0.0 110.095 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.97 -34.76 69.22 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.245 0.545 . . . . 0.0 109.991 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -56.79 -33.7 66.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.357 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -55.63 -17.95 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.37 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -58.81 -25.81 63.52 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 4.4 pp -55.43 -23.29 24.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.009 0.433 . . . . 0.0 110.593 178.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 74.7 t -55.41 -53.93 30.62 Favored 'Isoleucine or valine' 0 C--N 1.348 0.537 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.22 -20.11 61.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.355 176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.45 -20.52 37.91 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 16.3 m -59.04 -41.83 88.8 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 121.871 -0.782 . . . . 0.0 109.804 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -65.78 -50.5 64.48 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.552 0.692 . . . . 0.0 110.09 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.41 -35.4 79.1 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.188 0.518 . . . . 0.0 111.641 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 7.1 tt -59.6 -45.3 92.32 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.909 -0.495 . . . . 0.0 110.857 -178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 60.0 mt -63.61 -36.56 76.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.808 0.813 . . . . 0.0 108.857 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -30.28 69.13 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.584 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 95.6 m-20 -55.34 -49.4 72.33 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.715 0.769 . . . . 0.0 109.817 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -70.53 -44.69 67.01 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.0 -29.68 70.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -82.05 -45.47 15.23 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -42.68 65.13 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.683 0.754 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.83 -53.84 52.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.488 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.4 p -97.89 -49.48 4.78 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.427 0.632 . . . . 0.0 112.112 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.0 tt 64.9 104.86 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.995 0.902 . . . . 0.0 111.711 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.41 -76.06 0.06 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.84 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 13.3 m -112.78 172.14 7.11 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.429 -0.794 . . . . 0.0 112.071 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -37.54 30.17 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.116 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -53.08 -38.99 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.275 1.036 . . . . 0.0 109.027 178.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 18.7 tpt85 -61.13 -29.76 69.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.007 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.75 -33.08 71.2 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.854 -0.529 . . . . 0.0 110.537 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -56.66 -32.89 65.82 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -47.67 85.32 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.723 0.773 . . . . 0.0 110.142 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.68 -43.07 99.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.085 0.469 . . . . 0.0 111.046 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 65.2 mt -74.01 -41.15 62.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 1.9 pp -70.26 -37.22 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 121.765 -0.585 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 40.7 t -61.25 -46.08 97.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.503 -0.748 . . . . 0.0 109.786 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 5.0 t -63.77 -41.99 97.87 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 121.766 -0.583 . . . . 0.0 112.085 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -31.86 72.12 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.84 -0.537 . . . . 0.0 111.756 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.73 -36.47 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 122.03 -0.419 . . . . 0.0 110.754 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 8.9 m -54.06 -38.26 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.572 -0.705 . . . . 0.0 109.908 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -61.22 -41.86 97.6 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.561 0.696 . . . . 0.0 110.425 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.14 -44.06 80.78 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.708 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 27.9 tp -82.88 -13.96 55.15 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.293 0.568 . . . . 0.0 111.351 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.99 -42.41 60.66 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.98 133.19 41.98 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.607 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.43 0.633 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -113.13 152.6 29.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.344 0.592 . . . . 0.0 109.581 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -167.61 158.11 10.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.319 0.58 . . . . 0.0 109.719 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -53.62 47.88 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 122.135 0.969 . . . . 0.0 109.62 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -66.76 -18.53 65.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.062 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -81.12 -48.44 12.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.062 0.458 . . . . 0.0 110.495 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -56.6 -46.42 80.88 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.28 0.562 . . . . 0.0 110.338 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.11 -25.67 67.11 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.325 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -35.64 81.54 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 122.077 -0.389 . . . . 0.0 111.463 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.5 -35.92 77.09 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.224 0.535 . . . . 0.0 111.424 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -59.91 -26.74 66.16 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.129 0.49 . . . . 0.0 110.826 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -74.09 -34.38 63.96 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.233 0.54 . . . . 0.0 110.975 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -53.83 -43.64 69.59 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.487 0.66 . . . . 0.0 110.552 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 55.89 41.34 30.12 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.404 0.621 . . . . 0.0 111.165 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -156.67 -72.63 0.1 Allowed 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.724 -0.61 . . . . 0.0 112.18 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.19 -37.6 78.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-O 121.508 0.67 . . . . 0.0 111.684 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.18 -33.65 41.59 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.987 -0.446 . . . . 0.0 112.163 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -56.97 -49.52 75.46 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.592 0.711 . . . . 0.0 110.205 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -65.22 -40.79 94.59 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.193 0.52 . . . . 0.0 109.788 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 13.7 mt -66.07 -38.25 87.82 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -96.02 -18.48 20.19 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.42 -16.06 31.77 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.644 -0.66 . . . . 0.0 111.809 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.471 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 6.3 pt -62.93 -37.02 78.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.785 -0.572 . . . . 0.0 111.439 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -53.79 -47.38 70.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.611 0.719 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.92 -36.52 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . 0.471 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.74 -32.09 70.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.376 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 9.4 mm -61.16 -47.78 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.168 0.509 . . . . 0.0 109.856 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.4 mt -62.48 -39.86 85.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.206 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.86 -36.83 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 75.8 t -53.98 -40.05 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.8 -41.15 90.66 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.2 m -64.44 -37.8 88.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.656 0.741 . . . . 0.0 109.488 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -59.52 -43.54 93.38 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.262 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -41.9 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 122.114 -0.366 . . . . 0.0 110.975 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.67 -26.65 65.15 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.47 -40.33 85.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.882 0.849 . . . . 0.0 110.376 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -55.65 -28.98 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.7 tt -59.31 -35.63 59.23 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.501 -0.75 . . . . 0.0 111.416 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 8.9 p -54.1 -29.82 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -55.9 -31.32 62.75 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.793 -0.567 . . . . 0.0 110.303 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.45 81.28 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.08 -41.89 81.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.91 -37.34 79.16 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.568 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 73.5 m -62.64 -39.31 93.44 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.989 0.423 . . . . 0.0 110.765 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -40.91 96.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.868 0.842 . . . . 0.0 108.857 178.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.04 -44.69 99.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -62.23 -35.64 79.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.593 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . 0.416 ' CZ ' ' CD1' ' A' ' 712' ' ' TYR . 2.5 tmm_? -60.07 -50.92 71.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.907 0.86 . . . . 0.0 111.078 -177.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.72 -44.3 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.813 0.816 . . . . 0.0 111.167 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -72.97 -34.71 66.65 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.405 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 8.3 tt0 -102.82 -20.89 14.14 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 115.58 -177.27 17.07 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -128.25 -50.96 1.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 713' ' ' SER . . . . . 0.524 ' HA ' HG22 ' B' ' 708' ' ' VAL . 31.6 p -106.78 159.48 29.74 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.356 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -34.06 94.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 122.424 2.082 . . . . 0.0 112.869 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 18.8 tp -81.03 -1.88 45.76 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.958 0.885 . . . . 0.0 113.315 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.797 0.808 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 tpt85 -59.03 -30.5 68.07 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.254 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -56.43 -13.38 2.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 16.8 mtm-85 -75.57 -44.84 41.12 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.565 -0.709 . . . . 0.0 111.468 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.35 -44.36 88.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.188 0.518 . . . . 0.0 109.991 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -36.04 71.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.041 0.448 . . . . 0.0 110.327 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -57.56 -42.86 83.87 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.908 -0.495 . . . . 0.0 110.274 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.96 -19.74 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.635 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -59.44 -34.26 72.29 Favored 'General case' 0 C--N 1.343 0.285 0 O-C-N 121.071 -1.018 . . . . 0.0 109.26 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 9.6 tt -57.35 -17.64 13.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.84 -53.35 38.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -71.89 -18.68 62.03 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.558 0.694 . . . . 0.0 109.568 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.27 -20.58 36.8 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.9 p -58.31 -37.9 75.99 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -69.22 -50.34 48.22 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.653 0.74 . . . . 0.0 109.232 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.09 -34.64 72.22 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.935 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.71 -45.47 89.48 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.908 -0.495 . . . . 0.0 111.067 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 74.2 mt -68.26 -41.78 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.771 0.796 . . . . 0.0 108.981 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -67.1 -30.68 70.77 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.74 -45.67 92.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.224 -0.923 . . . . 0.0 108.608 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -42.27 72.69 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.595 0.712 . . . . 0.0 110.975 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -42.64 76.63 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -74.57 -49.44 21.78 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.062 0.458 . . . . 0.0 111.841 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.6 t -59.77 -45.85 91.0 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.478 -0.764 . . . . 0.0 110.18 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.2 tt -68.84 -54.15 17.34 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -99.19 -49.63 4.42 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.826 0.822 . . . . 0.0 112.785 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 77.41 -179.53 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.474 0.709 . . . . 0.0 109.368 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.99 138.09 6.84 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.476 0.655 . . . . 0.0 111.156 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 m 57.94 165.07 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.5 0.667 . . . . 0.0 111.065 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.32 0.65 43.38 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.402 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -81.62 -44.76 16.76 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 -64.15 -28.36 69.71 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.561 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.18 -30.1 66.16 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -56.61 -32.88 65.72 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -65.27 -47.32 77.12 Favored 'General case' 0 C--N 1.352 0.693 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.2 -37.6 77.86 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.603 0.716 . . . . 0.0 110.319 178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.68 -36.35 71.82 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.652 0.739 . . . . 0.0 109.909 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.89 -40.42 60.93 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.507 -0.746 . . . . 0.0 110.361 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 41.9 mt -62.88 -37.37 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 O-C-N 122.252 -0.28 . . . . 0.0 111.618 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 29.6 m -55.44 -39.59 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.281 -178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.7 m -63.47 -40.67 97.72 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-O 121.971 0.891 . . . . 0.0 109.584 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.81 -38.42 86.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.657 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.421 HG23 ' HA ' ' A' ' 743' ' ' ASP . 63.9 mt -60.56 -42.22 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.8 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 48.6 t -53.7 -38.33 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.631 -178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 . . . . . 0 CA--C 1.54 0.586 0 O-C-N 121.93 -0.481 . . . . 0.0 111.358 178.424 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.5 tp . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 47.3 mt 58.13 104.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.772 0.796 . . . . 0.0 110.834 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -174.65 -171.51 0.57 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.69 -41.22 63.67 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.564 -0.71 . . . . 0.0 110.635 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.5 -32.24 66.02 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -77.48 -44.93 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.435 0.636 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -70.46 -44.64 67.33 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.3 0.571 . . . . 0.0 110.847 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.79 65.82 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.524 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 46.3 t -66.92 -34.94 78.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.208 0.528 . . . . 0.0 111.271 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -35.22 74.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.376 0.608 . . . . 0.0 111.079 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.88 -22.79 62.82 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.203 0.525 . . . . 0.0 111.242 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -79.86 -20.81 45.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.247 0.546 . . . . 0.0 111.264 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -71.55 -49.79 37.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.598 0.713 . . . . 0.0 110.456 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 39.3 t80 62.15 39.38 12.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.832 0.825 . . . . 0.0 111.118 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -152.77 -68.3 0.16 Allowed 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.83 -0.544 . . . . 0.0 110.94 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.07 -36.95 77.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.096 -0.377 . . . . 0.0 111.213 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -51.81 -34.35 39.71 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.84 -50.1 67.99 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 121.685 -0.634 . . . . 0.0 110.32 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -65.69 -44.01 87.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.79 0.805 . . . . 0.0 109.695 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -35.72 81.33 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -96.13 -43.72 7.62 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -68.21 -6.66 24.72 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.693 -0.629 . . . . 0.0 112.552 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.7 pp -60.63 -36.43 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 121.626 -0.671 . . . . 0.0 110.403 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 9.9 ttt-85 -57.06 -47.27 81.38 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.046 0.45 . . . . 0.0 110.606 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -67.74 -34.13 65.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -31.33 69.72 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.041 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 14.5 mm -60.7 -49.31 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.117 0.484 . . . . 0.0 109.824 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.79 -40.39 84.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.99 -36.77 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.86 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.16 -39.83 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.4 -37.09 91.5 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.4 m -64.87 -38.29 90.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.759 0.79 . . . . 0.0 109.602 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -40.8 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.339 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.81 -23.41 61.15 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.63 -38.28 87.09 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.03 0.919 . . . . 0.0 109.506 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.5 mmt180 -55.92 -28.0 54.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.286 1.034 . . . . 0.0 112.767 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 mm -58.7 -37.44 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 O-C-N 121.077 -1.014 . . . . 0.0 108.339 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.5 p -67.72 -30.74 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 121.481 -0.762 . . . . 0.0 109.887 176.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.5 m-85 -55.88 -28.68 57.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 110.442 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.04 71.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 4.8 m -64.49 -36.0 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.669 -0.644 . . . . 0.0 110.043 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.2 tp -57.7 -40.05 78.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 122.028 -0.42 . . . . 0.0 111.016 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.6 m -62.78 -37.41 86.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.534 0.683 . . . . 0.0 110.499 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -42.0 96.7 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 122.089 0.947 . . . . 0.0 108.702 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.18 -43.74 95.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.981 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.22 -42.89 99.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.356 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -60.99 -43.79 98.36 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.411 0.624 . . . . 0.0 110.697 -178.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.4 -43.47 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.178 0.989 . . . . 0.0 109.179 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.13 -15.04 61.49 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -22.3 14.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.62 1.554 . . . . 0.0 113.268 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.98 14.07 1.89 Allowed Glycine 0 CA--C 1.537 1.422 0 O-C-N 121.376 -0.828 . . . . 0.0 113.544 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.33 -127.62 0.83 Allowed 'General case' 0 CA--C 1.571 1.775 0 O-C-N 121.556 -0.967 . . . . 0.0 110.466 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 89.3 p -62.08 159.9 34.41 Favored Pre-proline 0 C--N 1.353 0.72 0 O-C-N 120.669 -1.27 . . . . 0.0 110.782 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -35.12 110.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.301 2.0 . . . . 0.0 112.593 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.04 -20.73 12.92 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 122.56 1.172 . . . . 0.0 111.798 -179.622 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 121.683 0.754 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -58.02 -26.47 62.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.595 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -9.23 0.42 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 8.1 mtm-85 -62.89 -46.53 87.38 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.369 -0.832 . . . . 0.0 111.142 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 44.4 p-10 -65.84 -38.68 89.51 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.283 0.563 . . . . 0.0 111.871 -178.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -71.44 -38.01 71.39 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 121.163 -0.96 . . . . 0.0 109.845 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 20.6 p -66.25 -45.96 78.77 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.948 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.422 ' HB ' HG23 ' C' ' 781' ' ' ILE . 1.4 mp -63.12 -46.74 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-O 117.89 -1.053 . . . . 0.0 111.262 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.427 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.321 0.1 OUTLIER -69.93 -0.06 6.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 115.822 -2.351 . . . . 0.0 111.614 -177.624 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.23 -15.65 6.41 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 169.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.425 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.314 2.0 t -53.4 -54.64 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 175.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.407 ' H ' HD21 ' A' ' 750' ' ' ASN . 1.3 m-80 -73.25 -27.21 61.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.48 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.8 -19.3 28.35 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.697 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 52.2 p -57.27 -37.23 72.07 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.91 -49.45 76.15 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.29 72.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.646 178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.15 -43.24 92.04 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.706 -0.621 . . . . 0.0 111.899 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -33.66 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -69.43 -30.63 68.6 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.947 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.472 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 5.7 m-20 -56.07 -48.44 76.07 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.985 0.898 . . . . 0.0 108.955 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.39 -44.3 68.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.509 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 30.1 mt -67.37 -35.0 78.46 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 32.4 mtm180 -79.73 -19.51 48.63 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 68.6 p -77.36 -46.39 22.99 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.34 -0.85 . . . . 0.0 111.27 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 2.8 mp -68.89 -53.97 18.16 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 53.8 p -98.45 -48.95 4.83 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.221 -0.924 . . . . 0.0 111.939 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.8 tp 89.22 -82.97 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.675 1.19 . . . . 0.0 110.263 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -106.05 -65.42 1.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.572 -0.705 . . . . 0.0 110.756 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.6 m -103.05 144.44 31.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.117 0.484 . . . . 0.0 110.596 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -62.41 -26.74 68.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.085 0.469 . . . . 0.0 110.373 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -52.98 -39.06 62.73 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.599 0.714 . . . . 0.0 109.885 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.4 tpt85 -63.35 -30.62 71.72 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.662 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.42 -38.24 83.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.165 0.507 . . . . 0.0 110.481 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 58.0 ttp180 -59.03 -42.16 89.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.648 0.737 . . . . 0.0 109.207 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -69.05 -43.42 74.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.821 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.416 ' O ' HG13 ' A' ' 777' ' ' ILE . 0.7 OUTLIER -62.16 -37.7 86.19 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 121.53 0.681 . . . . 0.0 111.46 -179.317 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.39 -36.92 83.83 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 121.65 -0.656 . . . . 0.0 111.062 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.4 mt -74.15 -44.43 53.63 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 774' ' ' LEU . 2.3 pp -59.96 -37.14 71.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 121.98 -0.45 . . . . 0.0 111.419 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 26.7 m -65.92 -43.17 93.0 Favored 'Isoleucine or valine' 0 C--N 1.346 0.42 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.757 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 47.2 p -63.81 -46.6 84.39 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.433 -0.792 . . . . 0.0 111.508 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.11 -30.32 71.5 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -35.24 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 O-C-N 121.847 -0.533 . . . . 0.0 110.563 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 17.1 m -53.76 -38.33 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -62.69 -43.22 99.37 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.761 0.791 . . . . 0.0 110.216 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 22.5 tp -68.03 -40.98 82.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.359 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 120.988 0.423 . . . . 0.0 111.826 -179.246 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.2 mm? 61.91 112.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.227 0.536 . . . . 0.0 109.865 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 170.99 -176.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 5.7 tp -54.33 -48.42 71.39 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 122.171 0.986 . . . . 0.0 109.663 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -65.4 -32.44 74.07 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.541 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -78.73 -44.18 24.07 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.151 0.5 . . . . 0.0 110.726 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.73 -44.08 62.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.299 0.571 . . . . 0.0 111.319 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.57 -30.28 71.2 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.999 0.428 . . . . 0.0 111.534 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 24.5 p -63.35 -25.79 68.46 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.068 0.461 . . . . 0.0 111.699 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.05 -38.67 86.99 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.304 0.574 . . . . 0.0 110.963 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -61.71 -12.98 19.05 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.978 0.418 . . . . 0.0 111.537 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.64 -32.28 20.65 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.241 0.543 . . . . 0.0 111.252 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.57 -52.19 64.4 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.48 0.657 . . . . 0.0 110.507 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 33.1 t80 58.19 27.76 15.56 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.409 0.623 . . . . 0.0 112.184 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -141.07 -71.17 0.36 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.436 0.636 . . . . 0.0 110.455 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -36.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.4 m -51.28 -33.49 28.86 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.039 -0.413 . . . . 0.0 111.539 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.94 -50.31 73.01 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -66.16 -41.86 89.77 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.933 0.873 . . . . 0.0 109.422 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -35.52 71.49 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -109.46 -31.19 7.61 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -68.22 -6.76 25.34 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.451 -0.781 . . . . 0.0 112.91 -177.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.479 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 0.2 OUTLIER -60.41 -36.29 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.6 -0.688 . . . . 0.0 110.839 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -53.32 -47.6 69.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.615 0.245 . . . . 0.0 111.028 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.54 -35.64 57.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.479 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.7 -31.07 69.25 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.064 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.89 -47.28 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.774 -0.579 . . . . 0.0 109.918 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.71 -41.67 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.72 -37.94 73.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -60.18 -40.15 82.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.41 -27.1 67.24 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 19.9 m -60.78 -45.38 94.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.422 HD13 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -33.13 71.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -176.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.422 ' H ' HD13 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.86 -43.93 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.932 0.787 . . . . 0.0 109.739 -178.7 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.05 -32.68 83.11 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.46 -37.48 81.12 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 122.067 0.937 . . . . 0.0 110.769 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -55.87 -28.49 56.8 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . 0.427 HG23 HD12 ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.59 -36.39 59.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 O-C-N 120.978 -1.076 . . . . 0.0 110.419 -176.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.82 -30.22 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 121.253 -0.905 . . . . 0.0 110.561 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -56.53 -30.92 63.61 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.711 -0.618 . . . . 0.0 110.317 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.69 77.75 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -41.82 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.48 -37.74 73.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.077 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.7 m -62.86 -35.46 80.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 110.537 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.77 -43.21 97.07 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 122.406 1.098 . . . . 0.0 108.997 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.39 -45.49 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.201 1.001 . . . . 0.0 109.354 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.5 m-80 -62.82 -35.58 80.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.199 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 16.1 ttm-85 -66.41 -50.25 64.06 Favored 'General case' 0 N--CA 1.44 -0.934 0 O-C-N 121.301 -0.874 . . . . 0.0 110.688 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . 0.567 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.9 OUTLIER -78.72 -45.07 25.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -179.143 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -61.38 -45.23 95.24 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.4 pt20 -104.54 -22.89 13.2 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.66 167.64 11.03 Favored Glycine 0 CA--C 1.534 1.231 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.82 -83.6 0.55 Allowed 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.795 -0.827 . . . . 0.0 112.65 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.8 m -62.87 159.44 45.47 Favored Pre-proline 0 N--CA 1.463 0.184 0 O-C-N 121.331 -0.855 . . . . 0.0 110.177 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -30.08 108.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.529 2.153 . . . . 0.0 113.372 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.44 ' O ' ' C ' ' B' ' 716' ' ' SER . 4.8 tt -70.92 -20.38 62.49 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.44 ' C ' ' O ' ' B' ' 715' ' ' LEU . 12.4 t . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 122.402 1.096 . . . . 0.0 112.91 -178.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 11.9 mp0 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 mtp85 -72.24 -28.51 63.2 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.202 0.525 . . . . 0.0 110.975 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.9 -5.19 1.92 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.87 -32.71 61.1 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.701 -1.249 . . . . 0.0 109.423 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -58.59 -34.61 71.29 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 122.08 0.943 . . . . 0.0 108.553 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . 0.442 HH21 ' HG2' ' B' ' 744' ' ' ARG . 0.0 OUTLIER -63.54 -46.96 83.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 122.141 0.972 . . . . 0.0 109.135 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 13.8 t -62.34 -47.18 85.37 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.783 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.4 mp -52.63 -21.4 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 O-C-N 121.24 -0.912 . . . . 0.0 109.655 178.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -43.54 98.64 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.669 -0.645 . . . . 0.0 110.542 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -15.37 2.84 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.668 -0.645 . . . . 0.0 111.964 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.44 -53.76 32.57 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -72.59 -17.77 61.66 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.125 174.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.0 -20.06 32.74 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.857 -177.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 3.5 m -58.47 -38.45 77.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 118.356 1.078 . . . . 0.0 109.572 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.33 -48.04 58.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.65 0.738 . . . . 0.0 109.731 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.56 81.38 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -45.24 92.87 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.649 -0.657 . . . . 0.0 110.627 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.01 -36.4 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.11 -30.96 69.34 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.952 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -55.94 -48.32 75.96 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.56 -45.32 65.67 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.034 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.9 mt -66.91 -31.79 72.61 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -79.98 -49.47 11.79 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.2 m -65.24 -45.23 85.48 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.543 -0.723 . . . . 0.0 111.576 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.66 -53.25 50.48 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.838 -0.539 . . . . 0.0 112.447 -178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 3.0 m -97.5 -47.57 5.61 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 1.8 mt 71.63 107.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.8 0.81 . . . . 0.0 110.315 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.89 -78.45 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.881 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -110.11 175.47 5.42 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.612 0.72 . . . . 0.0 111.572 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -84.22 -27.96 27.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.064 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.61 -40.14 82.43 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 122.109 0.957 . . . . 0.0 109.149 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.62 -29.26 67.88 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.892 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.16 -32.33 69.79 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.679 -0.638 . . . . 0.0 109.986 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -56.78 -32.51 65.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.03 -41.26 99.47 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 2.7 tp -58.86 -38.49 78.9 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-O 121.388 0.613 . . . . 0.0 110.835 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.34 -37.04 74.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.275 0.56 . . . . 0.0 109.997 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.42 -34.85 68.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.056 0.455 . . . . 0.0 110.592 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.3 -39.26 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.089 0.471 . . . . 0.0 109.779 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.28 -46.63 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.784 -0.572 . . . . 0.0 109.945 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -44.48 91.82 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 122.079 -0.388 . . . . 0.0 112.023 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -31.5 72.04 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 122.052 -0.405 . . . . 0.0 111.739 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -36.6 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 O-C-N 121.727 -0.608 . . . . 0.0 112.07 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 5.4 m -59.22 -41.78 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 121.655 -0.653 . . . . 0.0 112.083 -177.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -41.85 91.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.273 0.559 . . . . 0.0 111.338 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.68 -44.04 67.84 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 18.9 tp -83.78 -22.87 31.72 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.027 0.441 . . . . 0.0 111.73 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.67 -33.21 62.49 Favored Glycine 0 CA--C 1.533 1.217 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -83.19 146.99 28.3 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.398 0.618 . . . . 0.0 110.581 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.476 179.691 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 CA-C-O 120.641 0.258 . . . . 0.0 110.784 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 25.7 mt 59.62 110.74 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.519 0.676 . . . . 0.0 110.852 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.6 171.1 10.55 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 121.244 0.545 . . . . 0.0 109.711 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -50.48 72.41 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.62 0.724 . . . . 0.0 110.054 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -75.18 -16.86 60.48 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.908 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -80.96 -49.01 11.5 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.022 0.439 . . . . 0.0 110.881 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -62.71 -46.14 89.52 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.248 0.547 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.23 -23.54 67.47 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -30.55 68.24 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 122.003 -0.436 . . . . 0.0 111.781 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -39.67 94.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -59.47 -13.51 9.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.762 -0.586 . . . . 0.0 111.848 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -81.77 -21.11 37.99 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.277 0.561 . . . . 0.0 110.899 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -62.44 -42.22 99.3 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.648 0.737 . . . . 0.0 110.138 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 61.37 24.76 14.82 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -154.09 -72.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.562 -0.711 . . . . 0.0 112.313 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -37.1 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-O 121.52 0.676 . . . . 0.0 110.257 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.8 m -52.2 -33.7 42.16 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.778 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -56.52 -48.88 76.31 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 121.63 0.729 . . . . 0.0 109.341 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.8 t90 -58.86 -38.09 77.97 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.874 -0.516 . . . . 0.0 109.8 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 9.4 mt -60.72 -41.08 94.6 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -103.27 -39.22 6.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -68.87 -18.56 64.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.3 pp -60.45 -36.57 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.449 -0.782 . . . . 0.0 109.947 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 12.4 ttt-85 -53.7 -46.98 70.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.02 -35.23 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.97 -36.77 77.83 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.994 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 18.5 mm -60.78 -45.53 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.89 -38.43 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.91 -37.99 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.5 -40.01 72.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.29 -37.54 73.87 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.0 m -67.37 -38.64 85.08 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.452 1.12 . . . . 0.0 109.661 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -46.12 89.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.406 -177.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -60.29 -43.63 93.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 O-C-N 122.017 -0.427 . . . . 0.0 110.812 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.74 -30.68 73.17 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.6 tt -53.77 -37.22 63.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.058 0.932 . . . . 0.0 110.139 179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -55.69 -27.85 52.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.7 tt -57.66 -35.41 50.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.079 -1.013 . . . . 0.0 110.831 -175.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -29.86 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.223 -0.923 . . . . 0.0 109.527 177.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -56.83 -31.69 65.0 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.263 -0.898 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.14 -45.3 93.51 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 45.3 t -65.82 -35.86 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.009 177.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -64.95 -44.89 87.95 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.231 0.539 . . . . 0.0 110.865 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 36.3 p -64.13 -33.04 74.88 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.15 0.5 . . . . 0.0 110.776 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.75 95.23 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.833 0.825 . . . . 0.0 108.922 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.62 -45.81 84.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-O 122.149 0.976 . . . . 0.0 108.618 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.06 -36.48 83.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.224 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -49.21 73.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.208 0.528 . . . . 0.0 111.26 -177.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.73 -42.98 34.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.501 0.667 . . . . 0.0 111.511 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -70.38 -41.35 73.18 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -102.23 -22.13 14.23 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.759 0.79 . . . . 0.0 112.973 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.35 160.37 24.21 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -112.98 -47.63 3.03 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.936 -0.743 . . . . 0.0 111.536 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 713' ' ' SER . . . . . 0.567 ' HA ' HG21 ' B' ' 708' ' ' VAL . 79.5 p -69.11 144.28 95.14 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 118.616 -0.707 . . . . 0.0 110.306 -179.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -35.23 97.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.553 0 C-N-CA 122.261 1.974 . . . . 0.0 112.394 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 13.6 tp -75.19 5.1 5.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.82 0.819 . . . . 0.0 112.277 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 122.422 1.106 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -61.1 -26.55 67.74 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.61 -1.177 . . . . 0.0 112.084 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.7 -11.59 1.0 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -68.42 -40.89 81.03 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.53 -0.731 . . . . 0.0 111.46 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.33 -36.02 72.78 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 122.031 -0.418 . . . . 0.0 110.501 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -71.34 -46.73 59.84 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.337 0.589 . . . . 0.0 110.017 178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 3.1 p -59.93 -38.51 82.62 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.469 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -19.67 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -59.55 -28.11 66.81 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 15.7 mt -55.65 -20.39 13.8 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.915 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 70.7 t -56.0 -54.89 21.82 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -73.29 -21.9 60.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.784 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.15 33.32 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.206 -178.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 37.5 m -58.59 -37.73 76.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 117.921 0.861 . . . . 0.0 109.315 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -69.45 -50.44 45.55 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.496 0.665 . . . . 0.0 109.743 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.2 -35.36 80.06 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -59.82 -45.34 92.67 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 111.158 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 64.4 mt -67.77 -41.77 85.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.86 0.838 . . . . 0.0 109.338 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.14 -30.09 68.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.207 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -55.32 -48.87 73.5 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.495 -0.753 . . . . 0.0 109.987 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -70.58 -44.72 66.76 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.876 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 62.3 mt -68.88 -36.08 77.66 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 26.2 mtm180 -72.39 -50.02 29.63 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.965 -0.459 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.5 t -64.87 -44.45 89.65 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 122.159 0.981 . . . . 0.0 110.337 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.94 -53.17 28.36 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.212 -0.903 . . . . 0.0 113.225 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.3 m -96.78 -37.47 10.26 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 56.5 mt 62.06 116.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.466 0.651 . . . . 0.0 110.128 -178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 2.0 t80 59.29 -162.96 0.23 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.874 -0.516 . . . . 0.0 109.997 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 p -83.38 91.89 7.43 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.667 0.746 . . . . 0.0 111.671 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 42.42 -165.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.888 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 10.9 t60 75.91 -61.42 0.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -61.31 -30.06 70.26 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.702 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.04 -30.8 69.43 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 122.075 -0.391 . . . . 0.0 109.957 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -56.69 -35.15 68.15 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -67.12 -37.06 83.23 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -58.06 -38.49 76.41 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.064 0.459 . . . . 0.0 110.21 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.98 -37.59 77.16 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 110.943 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 51.1 mt -75.09 -39.99 60.33 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 121.675 -0.641 . . . . 0.0 111.339 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 29.1 mt -62.49 -37.49 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.563 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 7.8 m -55.16 -39.83 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.202 0.91 . . . . 0.0 110.015 -178.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 5.8 m -63.41 -39.8 95.47 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 121.871 0.843 . . . . 0.0 109.741 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.43 -37.55 83.2 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.536 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.422 HG23 ' HB ' ' A' ' 746' ' ' ILE . 89.4 mt -61.69 -47.69 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.41 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.427 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 20.7 m -54.13 -37.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 119.23 -0.988 . . . . 0.0 110.677 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 CA--C 1.543 0.696 0 CA-C-O 121.318 0.58 . . . . 0.0 111.694 179.199 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 121.669 0.747 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mt 61.92 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.996 0.903 . . . . 0.0 111.82 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 174.81 163.59 0.23 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.495 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -46.36 -41.48 13.52 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.64 0.733 . . . . 0.0 110.148 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -33.87 76.97 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.774 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -74.8 -44.77 47.7 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.417 0.627 . . . . 0.0 109.782 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -63.12 -46.39 87.53 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.436 0.636 . . . . 0.0 110.364 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.19 61.82 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.493 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 2.7 m -65.38 -33.25 75.52 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.35 -23.75 67.07 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.808 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -60.02 -29.47 68.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.933 -0.48 . . . . 0.0 111.586 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.8 -14.48 62.78 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 19.4 m95 -68.44 -49.63 58.5 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.439 0.638 . . . . 0.0 110.108 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 13.3 t80 65.83 2.77 2.28 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -126.04 -66.78 0.91 Allowed 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.279 -0.888 . . . . 0.0 111.942 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.42 -36.92 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 121.368 0.604 . . . . 0.0 111.025 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.07 -33.38 38.96 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.471 -178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -56.4 -49.57 74.1 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.507 0.67 . . . . 0.0 109.777 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -65.36 -43.9 89.34 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 121.084 0.469 . . . . 0.0 109.809 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.6 mt -61.92 -34.85 76.83 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.9 t90 -103.52 -15.03 15.97 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -94.5 -9.19 36.15 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . 0.467 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 0.2 OUTLIER -62.38 -35.95 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 O-C-N 121.371 -0.831 . . . . 0.0 110.818 179.054 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -47.42 68.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.783 0.325 . . . . 0.0 111.266 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.5 mp -70.9 -35.34 59.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -60.61 -29.0 68.94 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.584 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 15.9 mm -60.52 -51.06 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.739 -0.601 . . . . 0.0 110.123 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.62 -41.03 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.93 -37.49 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.31 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 61.6 t -54.86 -43.29 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -52.68 -40.08 55.44 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.9 m -65.49 -38.67 90.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.848 0.832 . . . . 0.0 109.615 177.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.73 -43.05 94.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.304 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.36 -42.7 94.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-O 121.126 0.489 . . . . 0.0 109.951 -178.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.85 -24.92 65.17 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 178.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.92 -38.61 70.51 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.021 0.915 . . . . 0.0 109.185 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.0 mmt180 -55.72 -28.15 54.26 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.827 0.851 . . . . 0.0 111.775 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.99 -39.09 77.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -30.76 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.662 -0.649 . . . . 0.0 109.963 176.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.9 m-85 -55.76 -29.34 59.45 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 122.003 -0.436 . . . . 0.0 110.692 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.56 -37.24 72.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.9 m -60.71 -35.98 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 O-C-N 121.701 -0.624 . . . . 0.0 109.503 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.92 -44.62 91.35 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.81 -0.556 . . . . 0.0 109.88 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -34.66 77.78 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 122.117 0.96 . . . . 0.0 108.819 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.427 HD21 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -60.63 -44.29 96.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 122.308 1.052 . . . . 0.0 108.272 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.2 t -66.81 -41.81 88.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.889 177.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -62.34 -36.91 83.68 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.036 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . 0.427 HH22 HD21 ' A' ' 704' ' ' LEU . 36.0 ttm105 -57.65 -49.49 76.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 120.833 -1.167 . . . . 0.0 110.481 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -76.97 -45.21 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.147 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -74.71 -18.33 60.53 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -101.26 -21.01 15.01 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 120.15 13.64 5.83 Favored Glycine 0 CA--C 1.542 1.78 0 O-C-N 121.604 -0.685 . . . . 0.0 113.115 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 59.29 -83.77 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 O-C-N 121.934 -0.745 . . . . 0.0 112.069 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 92.2 p -102.77 159.99 27.62 Favored Pre-proline 0 C--N 1.347 0.462 0 O-C-N 121.2 -0.938 . . . . 0.0 109.721 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -41.75 106.57 0.07 OUTLIER 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.386 1.391 . . . . 0.0 111.104 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.82 -20.64 13.53 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -175.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 121.498 0.666 . . . . 0.0 111.723 -179.642 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 . . . . . 0 C--O 1.237 0.395 0 CA-C-O 121.714 0.768 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -57.91 -26.29 62.0 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.305 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -15.65 2.87 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.915 -0.49 . . . . 0.0 111.394 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -62.61 -46.12 89.73 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.858 -0.526 . . . . 0.0 109.898 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -59.15 -33.89 71.44 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.849 0.833 . . . . 0.0 109.043 178.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.54 66.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.721 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 8.4 p -58.44 -44.46 89.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.835 -0.541 . . . . 0.0 110.204 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.52 -20.9 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.245 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 -59.14 -24.29 62.9 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.468 -0.77 . . . . 0.0 110.178 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.59 -17.87 62.9 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.984 -0.448 . . . . 0.0 111.576 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.427 HG23 ' ND2' ' A' ' 750' ' ' ASN . 29.9 m -55.76 -54.91 21.06 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 O-C-N 120.793 -1.192 . . . . 0.0 110.78 -178.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.427 ' ND2' HG23 ' A' ' 749' ' ' VAL . 1.2 m-80 -72.75 -21.42 61.02 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 173.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.68 30.82 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.699 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 3.3 p -57.92 -37.79 74.73 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.808 0.804 . . . . 0.0 109.261 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.9 tp -65.38 -49.48 69.15 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.98 -34.58 76.41 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.703 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.77 -44.85 90.74 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 122.013 -0.43 . . . . 0.0 111.477 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 6.7 mm -63.04 -33.33 60.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.29 -30.02 68.01 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.494 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.531 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 30.5 m-20 -54.97 -47.13 74.97 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.672 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.58 -45.2 65.83 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.733 0.778 . . . . 0.0 111.043 178.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 24.2 mt -62.54 -29.58 70.67 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 44.7 mtt85 -81.07 -23.28 38.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 9.9 t -75.75 -46.83 28.71 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.88 -1.137 . . . . 0.0 111.955 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -54.37 14.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 18.4 p -98.09 -36.97 9.92 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 73.35 -61.62 0.49 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.142 0.577 . . . . 0.0 110.745 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -139.13 -68.74 0.43 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.602 -0.686 . . . . 0.0 111.048 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.9 m -79.78 126.3 30.79 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.982 -0.449 . . . . 0.0 110.02 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -57.3 -20.42 28.16 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.967 0.413 . . . . 0.0 110.926 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.1 -40.19 95.02 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.982 0.896 . . . . 0.0 108.745 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -55.86 -29.22 59.54 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.268 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.3 -38.47 80.31 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.957 -0.464 . . . . 0.0 111.608 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -64.63 -32.83 74.67 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.333 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.75 -42.42 99.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.091 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.45 -42.19 86.83 Favored 'General case' 0 C--N 1.354 0.776 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.346 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.4 tp -59.06 -36.86 75.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.017 0.437 . . . . 0.0 112.163 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 26.5 mt -74.57 -44.39 51.12 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.953 -0.467 . . . . 0.0 111.529 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 34.3 pt -68.4 -37.19 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 O-C-N 122.119 -0.363 . . . . 0.0 111.312 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.74 -46.6 96.19 Favored 'Isoleucine or valine' 0 C--N 1.345 0.387 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.166 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 779' ' ' THR . . . . . 0.443 ' O ' HG23 ' A' ' 782' ' ' VAL . 36.7 p -64.66 -36.71 85.14 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.872 0.844 . . . . 0.0 110.813 177.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -43.87 77.24 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 35.3 pt -69.97 -36.73 70.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 779' ' ' THR . 21.3 m -55.76 -38.05 49.54 Favored 'Isoleucine or valine' 0 C--N 1.359 1.019 0 CA-C-N 119.427 1.012 . . . . 0.0 109.117 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.08 -50.36 69.35 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 121.826 0.822 . . . . 0.0 110.112 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.5 -41.03 98.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 CA--C 1.538 0.503 0 CA-C-O 121.339 0.59 . . . . 0.0 111.188 179.996 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 60.2 124.12 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.173 0.511 . . . . 0.0 110.598 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' B' ' 664' ' ' ASP . 0.4 OUTLIER -174.64 29.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.604 -0.685 . . . . 0.0 112.025 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' B' ' 662' ' ' GLU . 0.3 OUTLIER 75.06 -42.74 0.49 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.799 0.809 . . . . 0.0 109.657 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . 0.437 ' H ' ' C ' ' B' ' 662' ' ' GLU . 9.7 t70 -79.98 -31.87 39.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.762 0.792 . . . . 0.0 109.874 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.53 -41.54 79.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.507 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 89.1 m95 -75.02 -46.51 34.54 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.338 0.589 . . . . 0.0 111.534 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.29 71.19 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.87 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 88.3 p -62.76 -33.48 75.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.977 0.417 . . . . 0.0 111.474 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.82 -32.02 70.26 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.297 0.57 . . . . 0.0 111.081 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -62.55 -23.26 66.89 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.899 0.381 . . . . 0.0 111.918 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -81.79 -13.06 58.22 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.897 0.38 . . . . 0.0 111.813 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -69.98 -46.69 64.66 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.48 0.657 . . . . 0.0 110.903 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 47.8 t80 57.26 34.39 24.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.73 0.776 . . . . 0.0 110.939 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -140.7 -87.53 0.18 Allowed 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.781 -0.574 . . . . 0.0 111.139 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 18.5 tt -68.2 -35.98 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 O-C-N 121.57 -0.706 . . . . 0.0 112.178 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.2 m -50.38 -32.5 17.68 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.714 -0.616 . . . . 0.0 111.545 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -55.96 -44.86 78.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -43.7 97.14 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.838 0.828 . . . . 0.0 108.905 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.1 tp -57.86 -40.11 79.38 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.815 -178.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -100.85 -3.05 30.55 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -101.47 -23.14 14.38 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.589 -0.694 . . . . 0.0 112.164 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 28.8 pt -60.44 -35.83 65.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 O-C-N 121.875 -0.516 . . . . 0.0 110.494 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 22.3 ttt-85 -53.31 -47.2 69.46 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.792 -0.568 . . . . 0.0 110.098 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 3.1 mp -75.21 -36.3 36.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -27.66 66.58 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.874 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.47 -45.36 97.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.32 -43.57 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 97.0 mt -58.64 -37.74 67.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 45.5 t -61.69 -47.46 93.24 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.936 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.15 -27.06 13.8 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.774 -0.579 . . . . 0.0 112.205 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 37.0 m -60.63 -44.16 96.68 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.404 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.46 -32.39 70.19 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.154 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.404 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.5 OUTLIER -57.71 -44.58 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.301 -0.875 . . . . 0.0 108.694 -178.731 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.46 -31.55 77.88 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 178.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.18 -37.82 67.55 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 122.065 0.936 . . . . 0.0 109.467 178.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 24.0 mmt180 -55.65 -28.55 56.04 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -35.95 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 121.022 -1.048 . . . . 0.0 108.943 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 1.2 p -66.04 -30.2 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 O-C-N 121.901 -0.5 . . . . 0.0 110.269 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 3.4 m-85 -56.12 -30.71 62.49 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.828 -0.545 . . . . 0.0 109.532 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.81 77.29 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 177.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.38 -38.14 76.74 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.451 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 9.2 tp -58.72 -43.67 90.2 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.069 -0.395 . . . . 0.0 110.281 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 80.3 p -63.82 -31.72 73.0 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.778 0.799 . . . . 0.0 109.839 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -47.29 83.99 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 122.531 1.157 . . . . 0.0 109.142 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 56.1 t -70.19 -45.18 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.631 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.82 -36.04 81.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.143 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . 0.411 HH21 ' HG3' ' B' ' 707' ' ' ARG . 4.6 ttm-85 -63.11 -49.28 75.04 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.524 1.154 . . . . 0.0 109.772 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.28 -44.82 30.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 114.27 -1.332 . . . . 0.0 114.183 -178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -70.22 -45.02 67.39 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -175.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.531 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.9 pt20 -104.97 -22.96 13.04 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 127.94 177.43 14.86 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -129.97 -69.45 0.67 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 21.8 m -62.24 159.36 40.03 Favored Pre-proline 0 N--CA 1.467 0.391 0 O-C-N 121.312 -0.867 . . . . 0.0 109.24 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -34.26 102.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.16 1.907 . . . . 0.0 111.884 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.458 ' O ' ' C ' ' B' ' 716' ' ' SER . 0.5 OUTLIER -76.28 -20.0 57.75 Favored 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -175.393 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.458 ' C ' ' O ' ' B' ' 715' ' ' LEU . 77.6 p . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.524 0.678 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.16 -26.51 62.11 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -178.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -13.13 57.68 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.07 71.21 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 121.034 -1.041 . . . . 0.0 112.124 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.44 -45.27 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.28 -37.07 71.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.178 0.513 . . . . 0.0 110.208 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.8 m -57.13 -34.09 68.04 Favored 'General case' 0 C--O 1.231 0.084 0 CA-C-O 120.992 0.425 . . . . 0.0 110.49 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 23.1 mt -57.68 -16.08 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.66 -33.51 71.64 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 177.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.73 -16.16 3.97 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 39.6 t -55.77 -53.69 34.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 177.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.1 -19.93 61.72 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.084 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.87 31.53 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.834 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.22 -37.64 75.23 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.956 -0.732 . . . . 0.0 109.379 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.0 -48.58 57.58 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 108.945 177.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.71 -34.84 73.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.805 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.03 -42.93 91.4 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.992 0.425 . . . . 0.0 111.233 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 46.6 mm -67.77 -35.62 73.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.51 -33.53 74.3 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -55.92 -47.99 76.49 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.208 -0.933 . . . . 0.0 108.889 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.45 -45.13 66.41 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.088 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -46.07 90.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -81.87 -25.4 35.09 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.9 p -71.23 -46.45 61.07 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.944 -1.098 . . . . 0.0 111.648 -177.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -54.59 13.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.85 -33.94 10.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 68.52 88.42 0.11 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.743 0.782 . . . . 0.0 109.95 -176.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 58.98 -86.16 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.036 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -79.85 162.23 25.17 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 121.405 -0.809 . . . . 0.0 110.684 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -92.62 25.29 3.13 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.218 0.533 . . . . 0.0 111.479 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -90.98 -41.89 10.85 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.833 0.825 . . . . 0.0 109.149 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -29.46 70.34 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.32 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.37 -34.12 72.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -60.84 -43.18 98.63 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -69.56 -38.4 77.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -38.03 84.22 Favored 'General case' 0 C--N 1.344 0.341 0 O-C-N 121.659 -0.65 . . . . 0.0 111.308 -179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 20.0 mt -58.67 -37.17 75.43 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.577 -0.702 . . . . 0.0 111.665 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 pp -74.11 -34.29 63.88 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.73 -0.607 . . . . 0.0 112.169 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 10.2 pt -70.39 -36.27 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.076 -1.015 . . . . 0.0 110.005 177.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 57.9 t -55.11 -46.29 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 3.1 t -63.95 -35.64 81.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.484 -0.76 . . . . 0.0 109.581 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 9.7 tpt85 -61.27 -31.88 71.7 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.974 -0.454 . . . . 0.0 110.886 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 7.1 mm -61.19 -48.04 90.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 O-C-N 122.047 -0.408 . . . . 0.0 110.642 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.2 m -55.31 -38.22 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.504 -0.748 . . . . 0.0 111.11 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.61 -52.24 66.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.404 0.621 . . . . 0.0 110.76 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.1 -44.03 66.47 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.605 0.717 . . . . 0.0 111.966 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -14.56 61.39 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.682 -178.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -54.45 -40.88 70.77 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 11.5 ptp85 -100.93 130.55 46.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.334 0.587 . . . . 0.0 109.995 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.172 -0.918 . . . . 0.0 110.88 -179.228 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.125 0.488 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 7.3 mp 60.45 123.02 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.723 0.773 . . . . 0.0 111.392 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 178.8 171.29 0.83 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.85 -49.35 76.98 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.174 0.988 . . . . 0.0 109.238 178.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -67.12 -23.07 65.78 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.561 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -48.73 12.06 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.361 0.601 . . . . 0.0 110.071 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -63.44 -45.21 91.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.553 0.692 . . . . 0.0 110.315 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.75 -18.01 65.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.98 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.37 -33.52 67.3 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.923 -0.486 . . . . 0.0 111.778 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.15 -33.95 72.87 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -62.03 -17.58 57.78 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 121.645 -0.659 . . . . 0.0 111.801 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -86.05 -25.21 26.03 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.244 0.545 . . . . 0.0 111.133 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -62.84 -40.71 98.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.526 0.679 . . . . 0.0 110.237 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 58.35 34.67 24.23 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.093 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -161.03 -69.08 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.531 -0.731 . . . . 0.0 112.274 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -37.81 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 111.168 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.72 -33.91 50.13 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.977 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.69 -50.41 65.0 Favored 'General case' 0 C--O 1.223 -0.332 0 O-C-N 121.927 -0.483 . . . . 0.0 110.722 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -44.24 87.8 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.489 0.661 . . . . 0.0 109.797 178.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.14 -35.63 81.41 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.884 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -101.53 -9.77 20.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -92.09 -21.37 20.49 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.475 -0.765 . . . . 0.0 111.201 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.491 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.2 pt -60.71 -37.05 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.822 0.344 . . . . 0.0 110.16 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 -56.9 -47.3 80.84 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.481 0.658 . . . . 0.0 109.798 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.17 -34.16 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . 0.491 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -60.68 -29.91 69.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.469 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 10.0 mm -60.84 -47.89 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.429 0.633 . . . . 0.0 109.415 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -61.62 -40.38 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.82 -37.68 67.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 85.0 t -55.61 -41.12 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.55 -40.35 77.92 Favored Glycine 0 C--N 1.345 1.067 0 N-CA-C 108.813 -1.715 . . . . 0.0 108.813 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.1 -40.23 86.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.052 0.93 . . . . 0.0 109.373 177.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -46.68 89.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.576 -178.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.8 pp -68.53 -41.91 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 121.25 0.548 . . . . 0.0 110.375 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.28 -32.32 76.44 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 178.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.8 tt -60.08 -37.46 79.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.062 0.934 . . . . 0.0 110.158 178.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -55.98 -28.57 57.69 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.1 tt -58.56 -35.42 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.254 -0.904 . . . . 0.0 110.644 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.97 -29.23 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.728 -0.607 . . . . 0.0 110.621 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -54.9 -29.3 55.55 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.732 -0.605 . . . . 0.0 110.533 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.07 -37.63 74.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 3.2 m -68.87 -35.77 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-O 121.645 0.736 . . . . 0.0 109.372 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.12 -37.88 84.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.035 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 22.0 m -62.97 -36.35 83.2 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.248 0.547 . . . . 0.0 110.408 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.1 -40.67 94.88 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.304 1.05 . . . . 0.0 108.841 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.36 -45.1 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 3.2 m120 -63.05 -36.91 85.15 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.021 0.915 . . . . 0.0 110.793 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -51.21 70.61 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.353 1.073 . . . . 0.0 110.596 -178.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -78.3 -45.96 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.555 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.52 -40.24 61.88 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' C' ' 706' ' ' ASN . 0.0 OUTLIER -101.79 -21.44 14.6 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-O 121.665 0.745 . . . . 0.0 112.347 -176.572 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.46 -170.46 18.4 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -134.51 -53.36 0.83 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.863 -0.786 . . . . 0.0 112.059 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.55 145.76 85.26 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.178 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -36.07 110.25 0.07 OUTLIER 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.268 1.979 . . . . 0.0 112.397 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . 0.468 ' O ' ' C ' ' C' ' 716' ' ' SER . 2.9 mm? -74.35 -20.03 60.24 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -177.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 716' ' ' SER . . . . . 0.468 ' C ' ' O ' ' C' ' 715' ' ' LEU . 67.7 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 122.058 0.932 . . . . 0.0 113.082 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 122.151 0.976 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -58.52 -26.31 63.36 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.095 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -55.23 -10.42 0.56 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -75.76 -27.74 58.18 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.549 -0.72 . . . . 0.0 111.687 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -58.55 -44.07 89.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.389 0.614 . . . . 0.0 109.786 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -71.16 -36.08 71.88 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 9.6 t -56.78 -38.71 72.88 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 6.0 mt -52.97 -22.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.84 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -59.35 -27.6 66.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -22.54 39.65 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 122.185 -0.322 . . . . 0.0 111.606 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 83.5 t -55.41 -54.25 27.22 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -72.77 -32.03 65.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.166 -1.379 . . . . 0.0 108.792 174.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.46 -20.65 38.52 Favored Glycine 0 C--N 1.341 0.834 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.806 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 80.6 p -58.77 -37.97 77.45 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.766 -0.843 . . . . 0.0 109.025 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.8 tp -67.34 -48.15 68.37 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.764 0.792 . . . . 0.0 109.986 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.14 77.13 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.29 -45.32 91.59 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.858 -0.526 . . . . 0.0 111.976 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 3.2 pt -73.96 -32.88 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.32 0.581 . . . . 0.0 109.822 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -69.29 -30.32 68.39 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.805 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -55.71 -49.01 74.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.347 -0.846 . . . . 0.0 109.907 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -70.2 -44.45 68.66 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.362 0.601 . . . . 0.0 111.29 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.4 -40.6 97.01 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 111.463 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -78.45 -32.81 48.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.022 0.439 . . . . 0.0 111.405 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 37.5 t -66.63 -43.27 85.13 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.282 1.039 . . . . 0.0 110.063 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 3.2 tp -64.88 -53.57 44.59 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.08 -0.964 . . . . 0.0 113.387 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 23.3 t -97.82 -20.51 17.48 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 64.29 -75.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.745 0.307 . . . . 0.0 110.5 -177.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -108.5 -72.93 0.7 Allowed 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.476 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 23.6 t -133.86 175.71 9.21 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.518 0.675 . . . . 0.0 111.332 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -58.39 -38.3 77.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.152 0.501 . . . . 0.0 110.584 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -53.34 -46.49 69.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 122.105 0.955 . . . . 0.0 108.8 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 48.2 ttm-85 -72.45 -29.57 63.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.953 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -58.68 -29.66 66.78 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -56.39 -32.69 65.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -69.36 -34.52 74.7 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 118.382 -1.327 . . . . 0.0 109.666 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -38.42 82.33 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.35 -36.08 72.9 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.324 1.059 . . . . 0.0 108.304 176.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -37.6 65.82 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.221 178.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.64 -44.92 98.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.501 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 34.5 m -66.25 -40.86 87.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.229 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.1 m -63.14 -47.14 84.0 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.984 0.421 . . . . 0.0 111.881 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -39.23 83.93 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.813 -0.554 . . . . 0.0 111.871 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 94.3 mt -68.95 -41.94 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.768 -178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 26.4 m -55.89 -38.05 50.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.744 0 CA-C-N 119.773 1.169 . . . . 0.0 109.418 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 . . . . . 0 C--N 1.344 0.359 0 CA-C-O 121.699 0.762 . . . . 0.0 110.052 178.804 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 28.1 mt 77.61 112.23 0.07 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.989 0.9 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -176.29 -175.76 0.72 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 2.2 tt -56.07 -42.17 76.27 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.61 -0.681 . . . . 0.0 110.216 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.02 -34.48 64.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.125 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -73.96 -46.03 46.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.105 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -70.03 -45.95 66.1 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.976 0.417 . . . . 0.0 110.934 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.78 -26.55 65.27 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.985 0.421 . . . . 0.0 111.886 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.6 m -69.29 -32.26 71.29 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.292 0.568 . . . . 0.0 111.195 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.47 -31.71 72.48 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.447 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -59.61 -21.95 61.13 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.031 0.443 . . . . 0.0 111.267 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -75.09 -20.75 59.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.093 0.473 . . . . 0.0 111.432 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.83 -42.57 99.19 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.436 0.636 . . . . 0.0 110.973 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.4 t80 60.22 39.75 18.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.838 0.828 . . . . 0.0 110.848 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -160.98 -67.2 0.06 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.842 -0.536 . . . . 0.0 111.296 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.19 -37.13 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 122.131 -0.356 . . . . 0.0 111.83 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.0 m -52.31 -34.36 46.66 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -177.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -65.02 -49.89 68.41 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 121.507 0.67 . . . . 0.0 109.83 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.4 t90 -65.6 -41.22 93.02 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.675 0.75 . . . . 0.0 110.146 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -36.44 83.11 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -94.56 -40.16 10.0 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -74.12 -2.7 25.65 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.692 -0.63 . . . . 0.0 112.556 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -36.94 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 121.646 -0.659 . . . . 0.0 110.284 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -59.49 -47.26 86.19 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.009 -0.432 . . . . 0.0 110.584 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.76 -34.6 71.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.95 -32.05 70.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.483 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 15.7 mm -60.61 -46.73 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.988 0.423 . . . . 0.0 110.216 -179.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 83.8 mt -60.78 -40.36 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.92 -37.03 70.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.107 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 97.9 t -54.58 -40.02 48.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.6 -39.94 95.75 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.9 m -63.4 -38.44 91.14 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.806 0.812 . . . . 0.0 109.694 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.6 -43.95 93.55 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.327 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.31 -42.05 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.007 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.03 -22.5 57.94 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.91 -37.72 85.69 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.999 0.904 . . . . 0.0 109.306 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -55.51 -28.16 53.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.569 0.748 . . . . 0.0 111.618 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.03 -39.19 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 O-C-N 121.292 -0.88 . . . . 0.0 108.794 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.53 -31.26 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 O-C-N 121.582 -0.699 . . . . 0.0 110.184 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -56.01 -28.91 59.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.962 0.411 . . . . 0.0 110.607 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.48 -37.43 72.91 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 10.3 m -59.29 -35.87 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.539 0.685 . . . . 0.0 109.313 177.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.4 -37.81 62.82 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.525 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.5 m -62.65 -39.49 94.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.607 0.718 . . . . 0.0 110.091 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -41.93 97.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.558 1.17 . . . . 0.0 108.804 178.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 99.0 t -68.87 -37.07 76.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.317 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.56 -39.92 95.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.034 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -57.36 -48.44 79.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 122.348 1.071 . . . . 0.0 110.349 -178.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -72.94 -44.53 57.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.022 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -73.33 -14.47 61.3 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -178.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 8.35 44.47 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 73.14 20.79 80.06 Favored Glycine 0 CA--C 1.541 1.687 0 O-C-N 121.665 -0.647 . . . . 0.0 112.131 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 68.22 -129.29 0.12 Allowed 'General case' 0 CA--C 1.568 1.635 0 O-C-N 121.868 -0.783 . . . . 0.0 111.272 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 5.5 p -62.62 159.26 44.54 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 120.974 -1.078 . . . . 0.0 111.206 -178.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -45.15 97.96 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.46 1.44 . . . . 0.0 112.127 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.61 -20.41 16.35 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.85 0 O-C-N 121.766 -0.584 . . . . 0.0 112.133 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 121.917 0.865 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.7 mtt-85 -58.63 -26.33 63.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.746 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -54.85 -16.97 3.02 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.8 -0.563 . . . . 0.0 111.225 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 53.1 ttp85 -74.79 -46.01 39.75 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.759 -0.588 . . . . 0.0 110.527 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.91 -45.14 93.51 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.504 0.669 . . . . 0.0 110.587 -178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.41 -36.56 71.38 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 98.0 p -62.22 -36.14 81.03 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.204 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.447 ' HB ' HD11 ' C' ' 781' ' ' ILE . 1.2 mp -55.79 -46.76 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 120.577 -1.327 . . . . 0.0 110.283 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.477 ' HD3' ' ND2' ' A' ' 750' ' ' ASN . 0.0 OUTLIER -64.41 -2.2 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.758 -177.165 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.33 -15.53 16.82 Favored 'General case' 0 C--N 1.368 1.398 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . . . . . . . . 0.304 2.0 t -53.12 -54.0 19.57 Favored 'Isoleucine or valine' 0 C--N 1.345 0.375 0 C-N-CA 125.13 1.372 . . . . 0.0 107.439 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.477 ' ND2' ' HD3' ' A' ' 747' ' ' ARG . 1.5 m-80 -73.32 -14.34 61.28 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.324 175.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.16 -19.41 31.54 Favored Glycine 0 C--O 1.222 -0.622 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.519 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 94.0 p -57.64 -37.86 74.06 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 117.803 0.801 . . . . 0.0 109.147 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.4 tp -62.55 -51.07 68.84 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.8 -35.14 79.63 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 112.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -45.45 91.61 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.002 -0.436 . . . . 0.0 111.963 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.2 mt -61.84 -33.52 58.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.2 -30.49 68.68 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.536 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.4 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 5.1 m-20 -55.68 -48.93 74.23 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.319 -0.863 . . . . 0.0 109.271 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -70.64 -43.46 69.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.405 0.622 . . . . 0.0 111.757 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.42 -32.97 74.81 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.308 0.575 . . . . 0.0 112.114 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -74.42 -18.55 60.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.2 t -77.37 -46.4 22.93 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.579 -0.7 . . . . 0.0 111.634 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.09 -55.82 9.59 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -47.24 5.19 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.255 1.026 . . . . 0.0 112.15 -178.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 tt 84.22 -52.96 0.12 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.464 -176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -134.43 -72.6 0.48 Allowed 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.78 -0.575 . . . . 0.0 110.668 178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.9 152.93 19.83 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.884 -0.51 . . . . 0.0 110.323 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 -24.86 66.05 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.942 0.401 . . . . 0.0 110.897 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.18 -42.19 65.99 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.731 0.777 . . . . 0.0 109.54 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -62.95 -30.08 71.29 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.114 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 2.8 tt -59.87 -42.4 93.63 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.859 -0.525 . . . . 0.0 109.709 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -64.72 -33.51 76.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.658 0.742 . . . . 0.0 109.236 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -43.44 98.82 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.919 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 7.7 tt -58.38 -38.46 77.36 Favored 'General case' 0 C--N 1.349 0.544 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.172 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 13.1 mt -58.44 -36.88 74.34 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.774 -0.579 . . . . 0.0 112.028 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.8 -43.07 72.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.914 -0.491 . . . . 0.0 112.173 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 20.5 pt -65.19 -37.69 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 73.0 t -56.09 -45.42 80.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 O-C-N 121.98 -0.45 . . . . 0.0 110.631 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 19.9 p -63.62 -48.39 77.49 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.023 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -67.54 -31.34 71.37 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 36.8 mt -53.66 -36.21 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -178.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 5.2 m -55.63 -37.99 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.368 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -65.45 -44.68 86.51 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 121.503 0.668 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 13.1 tp -69.45 -38.2 77.68 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.158 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.516 0 CA-C-O 121.0 0.429 . . . . 0.0 111.475 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 63.53 119.6 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.624 0.726 . . . . 0.0 110.055 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 178.57 177.55 0.45 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.479 0.657 . . . . 0.0 110.172 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.5 tt -48.94 -62.52 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.793 0.806 . . . . 0.0 111.379 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -64.78 -21.16 66.72 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.408 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -79.97 -43.91 21.19 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.924 -0.485 . . . . 0.0 110.677 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -64.81 -46.09 83.47 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.665 0.745 . . . . 0.0 109.964 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.09 -23.74 67.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.771 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 42.8 p -68.45 -30.84 69.79 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.838 -0.539 . . . . 0.0 111.274 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.0 -33.19 72.86 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.485 0.659 . . . . 0.0 110.779 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 64.3 m95 -59.57 -18.87 44.43 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.366 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -84.92 -29.5 25.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.343 0.592 . . . . 0.0 110.744 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.7 m95 -57.6 -47.56 81.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.354 0.597 . . . . 0.0 110.74 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 18.8 t80 59.52 28.11 17.43 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.334 0.588 . . . . 0.0 111.323 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -138.68 -78.23 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.83 -0.544 . . . . 0.0 111.069 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -64.64 -36.98 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.681 -0.637 . . . . 0.0 111.254 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.81 -34.31 39.6 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.073 -0.392 . . . . 0.0 111.916 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -63.36 -50.15 71.08 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 109.575 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -65.65 -40.58 92.61 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-O 121.889 0.852 . . . . 0.0 109.879 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -35.68 81.61 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -101.83 -47.01 4.74 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -59.0 -15.1 11.45 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.61 -0.681 . . . . 0.0 112.224 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.3 pp -60.56 -36.28 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.623 -0.673 . . . . 0.0 110.459 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -53.85 -47.39 71.01 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -68.68 -37.34 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -28.25 67.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.786 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 16.9 mm -60.7 -49.6 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 O-C-N 121.781 -0.575 . . . . 0.0 109.924 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.37 -39.59 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.09 -37.95 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.66 -48.4 87.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.16 -26.75 9.51 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 7.4 m -60.06 -43.85 95.14 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.411 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.56 -31.84 69.8 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.413 -0.805 . . . . 0.0 112.374 -177.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.411 ' H ' HD11 ' B' ' 692' ' ' LEU . 1.1 pp -57.05 -46.13 84.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.452 -0.78 . . . . 0.0 109.757 -177.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.73 -31.36 77.79 Favored Glycine 0 CA--C 1.54 1.624 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.08 -37.19 66.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.906 0.86 . . . . 0.0 110.434 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.3 mmt180 -55.14 -28.23 51.17 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.53 -36.55 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 O-C-N 120.813 -1.179 . . . . 0.0 108.665 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.4 -30.84 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.418 -0.801 . . . . 0.0 109.65 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.7 m-85 -56.37 -30.64 62.95 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.759 -0.588 . . . . 0.0 109.724 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.64 -37.4 75.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -43.16 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -59.69 -37.97 80.28 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.121 0.486 . . . . 0.0 109.767 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.3 m -62.76 -32.96 74.21 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.219 0.533 . . . . 0.0 109.594 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -40.59 96.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.052 0.929 . . . . 0.0 108.617 177.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -46.17 82.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.564 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.87 -36.61 83.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.8 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.34 -50.18 55.11 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . 0.423 HG23 ' HA ' ' C' ' 713' ' ' SER . 0.5 OUTLIER -77.4 -41.98 30.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.645 0.736 . . . . 0.0 112.434 -179.222 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -58.01 -44.99 87.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.514 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.4 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.2 pt20 -104.61 -25.0 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.333 1.063 . . . . 0.0 113.24 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.95 153.55 8.0 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.511 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -85.85 -33.24 21.35 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 122.05 -0.676 . . . . 0.0 112.135 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.02 155.43 52.49 Favored Pre-proline 0 N--CA 1.471 0.601 0 CA-C-O 118.454 -0.784 . . . . 0.0 109.663 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -36.83 138.24 0.23 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.809 1.673 . . . . 0.0 112.285 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' B' ' 716' ' ' SER . 11.4 tp -100.55 -19.3 16.22 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 715' ' ' LEU . 6.9 t . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 122.346 1.07 . . . . 0.0 112.756 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.547 0.833 0 CA-C-O 122.045 0.926 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 3.1 ttp85 -72.42 -26.22 61.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.898 0.856 . . . . 0.0 111.454 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.32 -6.09 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -176.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -55.33 -39.11 69.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.248 0.931 . . . . 0.0 110.492 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.16 -43.72 87.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.165 0.507 . . . . 0.0 109.82 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.3 -42.86 68.14 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.567 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 93.8 p -56.54 -37.75 70.93 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.862 -0.524 . . . . 0.0 110.903 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.99 -10.28 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.836 177.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . 0.402 ' C ' ' HD3' ' B' ' 747' ' ' ARG . 0.0 OUTLIER -59.0 -27.11 65.12 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 121.211 -0.93 . . . . 0.0 108.863 177.683 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 33.9 tp -54.47 -21.91 11.27 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.643 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 92.4 t -55.39 -54.29 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -73.02 -24.7 60.76 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.282 174.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.95 -19.76 31.25 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.025 -0.989 . . . . 0.0 113.159 -176.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 35.6 t -58.17 -37.63 75.08 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.387 1.094 . . . . 0.0 108.993 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 33.1 tp -69.27 -51.07 41.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.152 0.501 . . . . 0.0 110.595 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.63 76.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.78 -45.37 92.51 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.574 -0.704 . . . . 0.0 111.852 -176.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 32.1 mm -64.99 -31.2 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.584 0.707 . . . . 0.0 109.24 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.39 68.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.947 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.21 -49.15 72.67 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.295 -0.878 . . . . 0.0 108.755 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.67 -44.6 66.69 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.455 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 24.6 mt -68.1 -46.27 71.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -177.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -63.38 -42.77 98.86 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.1 p -68.42 -45.45 72.58 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.443 0.639 . . . . 0.0 111.073 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -53.75 20.45 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.829 -0.544 . . . . 0.0 112.39 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.9 p -98.03 -49.35 4.79 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 76.89 92.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.898 0.856 . . . . 0.0 110.412 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 3.1 t80 71.45 -72.93 0.1 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.177 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 19.2 p -98.67 163.28 12.71 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.743 -0.598 . . . . 0.0 111.376 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.87 -33.51 21.24 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.661 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.81 -38.11 64.23 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 122.167 0.984 . . . . 0.0 109.156 178.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 9.6 tpt85 -59.27 -29.64 67.72 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.856 178.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.61 -37.73 79.39 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 110.706 -178.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -58.53 -35.62 72.57 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.128 0.49 . . . . 0.0 110.081 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -69.25 -48.98 60.32 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.138 0.494 . . . . 0.0 110.188 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.4 -37.73 84.5 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.747 0.784 . . . . 0.0 110.137 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.69 -36.92 72.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.58 -178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.15 -33.28 69.9 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 122.19 -0.319 . . . . 0.0 111.45 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 6.3 pt -70.15 -36.88 69.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 O-C-N 121.839 -0.538 . . . . 0.0 110.317 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.72 -46.19 93.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 O-C-N 121.526 -0.734 . . . . 0.0 110.344 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 3.2 t -63.33 -48.18 79.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.934 -0.479 . . . . 0.0 112.226 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.5 -31.68 71.96 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.756 -0.59 . . . . 0.0 111.445 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 22.6 mt -58.34 -36.32 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 121.88 -0.513 . . . . 0.0 110.652 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 5.9 m -53.87 -38.26 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 O-C-N 121.593 -0.692 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.28 -41.61 96.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.4 0.619 . . . . 0.0 110.573 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.73 -44.13 97.5 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.295 0.569 . . . . 0.0 110.954 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 30.3 tp -79.51 -24.95 41.91 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.007 0.432 . . . . 0.0 110.64 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.51 -43.04 10.43 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -97.78 113.66 25.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.686 0.755 . . . . 0.0 109.776 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.348 -178.564 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 122.398 1.094 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.54 169.26 24.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.884 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -174.58 167.41 3.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.572 0.701 . . . . 0.0 110.532 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.2 -48.69 75.9 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.067 0.937 . . . . 0.0 109.375 178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -28.96 68.51 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.396 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -71.22 -48.74 49.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.028 0.442 . . . . 0.0 111.018 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -56.84 -46.19 81.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.217 0.532 . . . . 0.0 110.486 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.35 85.65 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.185 0.516 . . . . 0.0 111.448 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 25.5 p -57.78 -34.5 69.65 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.138 0.495 . . . . 0.0 111.293 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 14.8 mt -60.52 -29.06 68.87 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.139 -0.351 . . . . 0.0 111.293 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 51.1 m95 -60.91 -21.11 63.05 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.909 -0.495 . . . . 0.0 110.993 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -84.98 -5.76 59.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 121.03 0.443 . . . . 0.0 111.352 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -89.86 30.65 1.03 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.323 0.582 . . . . 0.0 110.617 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -16.56 135.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 91.52 -48.93 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.688 1.595 . . . . 0.0 111.651 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . 0.403 HG23 HD12 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.82 -42.39 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.535 0.683 . . . . 0.0 111.571 -179.34 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.73 -33.69 49.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.568 -178.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -60.11 -49.92 75.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.391 0.615 . . . . 0.0 109.704 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -65.81 -42.76 90.25 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.685 0.755 . . . . 0.0 109.693 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -35.8 81.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -101.61 -23.27 14.29 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -83.09 -16.07 48.33 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.374 -0.829 . . . . 0.0 112.22 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.5 pp -60.53 -36.47 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 O-C-N 122.043 -0.411 . . . . 0.0 110.226 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -46.86 87.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.75 0.786 . . . . 0.0 109.789 179.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -73.18 -31.33 34.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 CA-C-O 121.423 0.63 . . . . 0.0 109.71 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -28.28 68.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.436 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 8.3 mm -61.79 -42.74 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 121.41 0.624 . . . . 0.0 109.562 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 66.4 mt -65.19 -37.64 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.92 -38.23 72.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 81.6 t -55.7 -40.41 60.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . 0.4 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.13 -40.43 74.42 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 177.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.6 m -66.35 -38.32 87.34 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.019 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.0 tp -60.21 -46.32 90.16 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.572 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . 0.4 HG13 ' O ' ' C' ' 690' ' ' GLY . 1.9 pp -67.88 -41.8 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 O-C-N 121.928 -0.483 . . . . 0.0 111.005 -178.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.39 -26.57 64.36 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.9 tt -66.07 -38.74 89.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.938 0.875 . . . . 0.0 110.138 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.15 -28.69 58.97 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.2 tt -58.77 -35.36 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 O-C-N 121.416 -0.802 . . . . 0.0 110.99 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.9 p -53.89 -29.77 18.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 O-C-N 121.495 -0.753 . . . . 0.0 110.474 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -55.91 -31.68 63.1 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.873 -0.517 . . . . 0.0 110.268 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.82 -37.64 79.76 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -45.13 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -56.69 -39.12 73.25 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.753 178.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.4 m -63.33 -38.84 92.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.997 0.427 . . . . 0.0 110.144 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -41.98 99.28 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.69 -45.61 98.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.84 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.274 1.035 . . . . 0.0 111.055 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . 0.41 ' HD2' ' C ' ' C' ' 707' ' ' ARG . 5.6 tmm_? -57.08 -51.06 70.79 Favored 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 121.301 -0.874 . . . . 0.0 110.654 -177.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -44.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -73.05 -44.19 61.03 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -103.28 -22.05 13.76 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.52 164.74 11.62 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -114.08 -47.62 2.94 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.474 0.654 . . . . 0.0 111.779 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 713' ' ' SER . . . . . 0.423 ' HA ' HG23 ' B' ' 708' ' ' VAL . 9.7 p -97.99 159.5 30.68 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -33.47 121.35 0.12 Allowed 'Trans proline' 0 N--CA 1.5 1.86 0 C-N-CA 122.19 1.927 . . . . 0.0 112.424 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.76 16.61 23.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 O-C-N 121.004 -1.06 . . . . 0.0 110.031 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 N--CA 1.467 0.419 0 CA-C-O 121.935 0.874 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 17.8 tpt85 -64.26 -30.73 71.77 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.333 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.75 -34.03 64.83 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.039 0.447 . . . . 0.0 111.05 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -58.1 -37.41 74.47 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.191 -0.318 . . . . 0.0 111.635 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -58.27 -39.28 78.81 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.461 -0.774 . . . . 0.0 108.975 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -36.46 71.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.376 177.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 54.2 p -61.7 -44.8 96.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.9 -0.5 . . . . 0.0 110.924 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.57 -28.67 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.286 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 4.9 mtm105 -59.81 -22.81 62.7 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.55 -0.719 . . . . 0.0 110.021 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.11 -18.58 65.37 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.031 0.444 . . . . 0.0 110.18 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 46.4 t -55.74 -54.66 23.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.579 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -72.9 -21.07 60.97 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.338 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.86 -20.19 32.25 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.518 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.1 p -58.15 -37.62 74.99 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.909 -0.76 . . . . 0.0 109.103 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 13.6 tp -65.63 -51.32 60.48 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.43 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.356 0.598 . . . . 0.0 111.854 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 5.5 tt -59.04 -45.34 90.98 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.0 0.429 . . . . 0.0 111.302 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 50.9 mt -72.08 -37.28 59.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.509 0.671 . . . . 0.0 109.689 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.33 -31.42 69.85 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.78 -45.88 78.05 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.146 -0.971 . . . . 0.0 110.241 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -70.29 -42.86 71.5 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.427 0.632 . . . . 0.0 110.976 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.31 -36.81 83.88 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -82.41 -31.37 29.64 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 68.9 m -73.37 -45.84 52.62 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.538 -0.726 . . . . 0.0 112.751 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -39.0 81.2 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.689 -0.632 . . . . 0.0 112.61 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 4.9 m -91.26 -34.27 15.03 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.832 -0.543 . . . . 0.0 111.53 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.06 60.88 1.43 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 122.304 1.05 . . . . 0.0 109.438 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.6 t80 60.53 160.53 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.327 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 50.4 m 55.69 -160.02 0.2 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -132.83 -34.39 1.14 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.371 -0.83 . . . . 0.0 110.463 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -53.5 -27.55 26.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.682 0.753 . . . . 0.0 109.888 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.48 -30.14 65.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.46 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.66 -30.84 69.03 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.842 -0.536 . . . . 0.0 110.038 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -32.83 67.76 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.657 0.742 . . . . 0.0 109.2 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.33 -34.37 77.56 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.516 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 9.0 tp -57.88 -38.35 75.62 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 121.804 -0.56 . . . . 0.0 110.287 -179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 49.8 mt -58.44 -39.47 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.769 0.795 . . . . 0.0 109.814 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.56 -41.69 60.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.666 0.746 . . . . 0.0 110.691 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.13 -41.57 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.02 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 27.9 m -65.09 -39.69 86.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 O-C-N 121.514 -0.741 . . . . 0.0 110.766 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -45.19 91.07 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 122.041 -0.412 . . . . 0.0 111.489 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -31.63 71.62 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.447 HD11 ' HB ' ' A' ' 746' ' ' ILE . 61.4 mt -64.54 -39.44 85.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 119.051 -0.5 . . . . 0.0 112.157 -178.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 29.2 m -53.16 -37.95 29.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 CA-C-N 119.846 1.203 . . . . 0.0 110.126 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 121.157 0.503 . . . . 0.0 111.446 179.886 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 61.4 mt 56.32 92.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.861 0.838 . . . . 0.0 110.927 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -164.58 178.14 7.57 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.054 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.79 -43.93 73.28 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.579 0.704 . . . . 0.0 110.441 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.38 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -73.95 -45.46 50.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.197 0.522 . . . . 0.0 110.943 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -70.18 -46.34 64.81 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.803 0.335 . . . . 0.0 111.174 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.75 -28.38 68.99 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.022 0.439 . . . . 0.0 112.159 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.3 t -65.35 -36.84 85.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.367 0.603 . . . . 0.0 111.022 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -23.65 66.96 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -59.62 -27.85 66.68 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.497 -0.752 . . . . 0.0 111.508 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -67.46 -24.03 65.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.883 -0.51 . . . . 0.0 111.625 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -54.96 -47.58 74.34 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.232 0.539 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 76.3 t80 60.77 7.49 1.46 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -118.01 -73.77 0.63 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.172 -0.955 . . . . 0.0 111.091 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 5.7 tt -68.06 -36.02 73.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 O-C-N 121.959 -0.463 . . . . 0.0 111.78 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 4.3 m -50.99 -33.58 25.35 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 122.033 -0.417 . . . . 0.0 111.351 -176.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.88 -49.2 75.79 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.544 0.688 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -44.29 87.46 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 121.659 -0.651 . . . . 0.0 110.498 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.18 -39.36 89.66 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.2 t90 -89.27 -8.49 53.3 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -107.67 -8.5 16.1 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.551 -0.718 . . . . 0.0 111.833 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.6 pt -60.53 -36.67 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 121.665 -0.647 . . . . 0.0 109.412 178.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.6 ttt-85 -53.45 -47.14 69.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 109.814 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.18 -36.09 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.83 -28.59 67.61 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.485 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 14.1 mm -61.67 -51.98 66.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.358 0.599 . . . . 0.0 109.76 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.18 -36.46 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.728 0.775 . . . . 0.0 109.384 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -36.95 58.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 95.9 t -54.06 -40.07 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.21 -39.67 82.08 Favored Glycine 0 CA--C 1.532 1.119 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.28 -38.51 85.18 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.116 0.96 . . . . 0.0 109.596 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.64 -46.12 89.97 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.172 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.4 pp -68.15 -43.29 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 122.045 -0.41 . . . . 0.0 111.333 -177.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.68 -23.43 60.88 Favored Glycine 0 CA--C 1.54 1.596 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.31 -37.98 79.11 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.256 1.027 . . . . 0.0 108.957 178.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -55.99 -28.45 57.24 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.599 0.76 . . . . 0.0 112.541 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.36 -41.27 83.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.366 -0.833 . . . . 0.0 109.206 -177.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -30.37 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.501 -0.75 . . . . 0.0 109.956 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -28.56 55.31 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.255 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -37.01 71.3 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 4.9 m -58.83 -36.76 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 O-C-N 121.59 -0.694 . . . . 0.0 109.316 177.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -56.15 -38.22 70.55 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 19.4 m -64.06 -39.3 93.78 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-O 121.563 0.697 . . . . 0.0 109.922 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -44.72 96.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.571 1.176 . . . . 0.0 108.533 178.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 40.1 t -64.36 -42.86 96.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 114.411 -1.268 . . . . 0.0 109.128 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.59 -42.12 99.37 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.285 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 mtm105 -60.89 -45.8 93.17 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.138 0.971 . . . . 0.0 111.474 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 3.0 t -75.89 -44.66 38.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.221 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -73.76 -14.69 61.16 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -16.23 28.66 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.04 -1.037 . . . . 0.0 113.06 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.98 34.36 3.49 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 121.639 -0.663 . . . . 0.0 111.98 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 55.58 -136.03 1.27 Allowed 'General case' 0 CA--C 1.561 1.4 0 O-C-N 122.031 -0.688 . . . . 0.0 110.828 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 713' ' ' SER . . . . . 0.414 ' HA ' HG22 ' C' ' 708' ' ' VAL . 17.1 m -62.86 157.76 57.78 Favored Pre-proline 0 C--N 1.35 0.611 0 O-C-N 120.859 -1.151 . . . . 0.0 112.106 -178.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -44.6 103.89 0.05 OUTLIER 'Trans proline' 0 N--CA 1.482 0.815 0 C-N-CA 121.763 1.642 . . . . 0.0 112.799 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -105.95 -20.61 13.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.564 0.697 . . . . 0.0 111.594 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 C-N-CA 123.378 0.671 . . . . 0.0 112.437 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 14.0 ttm-85 -59.3 -26.73 65.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.481 -179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -9.06 0.65 Allowed 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.746 -0.596 . . . . 0.0 112.389 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.4 ttm105 -60.0 -41.73 92.72 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.411 -0.805 . . . . 0.0 109.48 179.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.08 -41.11 82.38 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.534 0.683 . . . . 0.0 109.335 178.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -60.04 -46.83 88.23 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.279 -0.888 . . . . 0.0 108.955 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.8 p -69.15 -26.94 65.12 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.464 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 30.7 mt -74.89 -47.41 37.43 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-O 116.565 -1.683 . . . . 0.0 112.014 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.491 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.343 14.1 ttt180 -73.45 -3.85 30.04 Favored 'General case' 0 C--N 1.361 1.109 0 CA-C-N 122.721 2.509 . . . . 0.0 111.47 -178.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.46 -15.4 4.14 Favored 'General case' 0 CA--C 1.577 1.992 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 169.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.464 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.293 1.5 t -53.66 -54.2 20.81 Favored 'Isoleucine or valine' 0 C--N 1.363 1.182 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 175.172 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -72.52 -22.43 61.03 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.158 -1.383 . . . . 0.0 108.686 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.87 -19.39 29.26 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.1 t -57.45 -37.11 72.3 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 51.6 tp -61.31 -49.25 77.76 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.0 -34.75 72.21 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.657 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.67 -45.53 89.18 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.876 -0.515 . . . . 0.0 112.189 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 40.3 mt -61.55 -32.24 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.24 -30.38 68.51 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.76 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . 0.489 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.3 m-20 -55.51 -44.9 77.03 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.855 0.836 . . . . 0.0 109.248 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -70.41 -42.84 71.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.573 0.701 . . . . 0.0 111.372 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 22.6 mt -68.98 -29.85 68.14 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -79.16 -30.13 43.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.9 t -75.26 -45.02 42.71 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.951 0.881 . . . . 0.0 111.61 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -53.59 56.06 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 3.3 m -97.9 -24.11 15.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.353 -0.842 . . . . 0.0 113.237 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.6 mt 66.55 -73.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.906 0.384 . . . . 0.0 109.989 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -135.8 133.76 38.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 109.516 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m 58.48 168.74 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -91.14 -17.56 25.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 120.963 0.411 . . . . 0.0 111.813 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.8 -34.0 77.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.004 0.907 . . . . 0.0 109.773 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -62.64 -29.53 70.7 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.003 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.61 -45.52 91.68 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.891 -0.506 . . . . 0.0 111.928 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 1.3 ptt85 -64.02 -33.74 76.43 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.708 -0.797 . . . . 0.0 109.45 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.33 -39.59 78.08 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.78 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 1.8 tp -59.35 -38.49 80.52 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.971 -0.456 . . . . 0.0 111.2 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.11 -36.75 75.7 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 14.5 mt -67.86 -44.31 77.42 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 781' ' ' ILE . 6.0 pt -58.1 -36.5 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 91.7 t -53.54 -44.53 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 O-C-N 121.911 -0.493 . . . . 0.0 109.904 -177.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 51.7 p -63.79 -36.8 85.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.117 0.96 . . . . 0.0 109.649 177.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -34.11 76.55 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.832 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 777' ' ' ILE . 55.8 mt -68.76 -42.73 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.664 -0.647 . . . . 0.0 110.86 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.29 -38.55 82.43 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 O-C-N 121.467 -0.77 . . . . 0.0 110.343 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -42.86 91.98 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.713 0.768 . . . . 0.0 109.378 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.69 -37.06 85.42 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.496 0.665 . . . . 0.0 109.821 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.292 0.568 . . . . 0.0 110.251 179.795 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? 55.61 102.35 0.01 OUTLIER 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.649 0.738 . . . . 0.0 110.392 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.71 176.27 2.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.546 0.689 . . . . 0.0 110.12 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.51 -42.84 61.99 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.465 0.65 . . . . 0.0 110.878 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.67 -36.69 73.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.02 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -71.2 -46.44 61.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.102 0.477 . . . . 0.0 110.864 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -67.46 -45.99 74.36 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.298 0.57 . . . . 0.0 110.89 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -20.14 66.14 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 30.8 t -67.88 -35.28 78.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.168 0.509 . . . . 0.0 110.986 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.86 -29.18 68.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.255 0.55 . . . . 0.0 111.304 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 44.7 m95 -60.3 -27.13 67.06 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 0.0 111.624 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -87.91 -10.3 51.04 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.998 -0.439 . . . . 0.0 112.18 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 10.4 m95 -74.55 -54.24 7.87 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.484 0.659 . . . . 0.0 111.015 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.15 27.77 17.28 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.286 0.565 . . . . 0.0 111.358 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -135.86 -78.69 0.42 Allowed 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.622 -0.673 . . . . 0.0 111.435 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.04 -36.87 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-O 121.64 0.733 . . . . 0.0 110.899 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -51.95 -33.18 36.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.357 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -55.96 -47.71 77.11 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.646 -0.659 . . . . 0.0 109.851 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -59.64 -38.13 80.56 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.879 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.46 -44.41 89.25 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -87.73 -42.15 12.82 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -65.76 -25.59 67.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.5 pp -60.7 -36.64 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.774 -0.579 . . . . 0.0 110.887 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -56.93 -47.18 81.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.165 0.507 . . . . 0.0 110.655 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -68.62 -34.45 65.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -29.9 68.56 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.117 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 12.2 mm -60.85 -49.52 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.199 0.524 . . . . 0.0 109.995 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.26 -42.49 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 88.9 mt -58.79 -37.95 69.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 56.0 t -64.75 -46.82 90.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.08 -27.0 9.58 Favored Glycine 0 CA--C 1.541 1.704 0 O-C-N 121.746 -0.596 . . . . 0.0 112.08 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.9 m -60.37 -43.55 96.44 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.412 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -32.23 70.2 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.513 -0.742 . . . . 0.0 112.361 -177.8 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.412 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.11 -44.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.589 -0.694 . . . . 0.0 109.288 -177.631 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.97 -32.74 81.15 Favored Glycine 0 CA--C 1.538 1.518 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.24 -37.57 72.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.522 0.677 . . . . 0.0 110.908 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 5.8 mmt180 -55.32 -28.93 56.92 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.36 -36.22 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 120.798 -1.189 . . . . 0.0 109.076 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -62.33 -30.36 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 O-C-N 121.691 -0.631 . . . . 0.0 110.157 177.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.3 m-85 -56.2 -30.32 62.12 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 121.737 -0.602 . . . . 0.0 109.5 179.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.4 -37.42 75.28 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 177.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 -39.51 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.03 -36.66 73.04 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.533 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 16.5 m -61.8 -35.38 78.02 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 122.055 -0.403 . . . . 0.0 110.917 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.42 -43.76 93.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.23 1.015 . . . . 0.0 108.361 178.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.93 -42.1 93.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.166 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -62.19 -36.58 82.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.22 0.534 . . . . 0.0 110.856 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -68.63 -49.56 58.26 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 122.612 1.196 . . . . 0.0 110.509 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.37 -45.43 29.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -176.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -65.36 -45.94 82.16 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.437 -174.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 9.5 pt20 -105.92 -24.83 12.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.94 179.81 16.64 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -123.79 -63.84 1.19 Allowed 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.787 -0.831 . . . . 0.0 112.307 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.78 159.29 54.9 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-O 118.562 -0.732 . . . . 0.0 109.738 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -29.87 117.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.813 2.342 . . . . 0.0 112.703 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.3 tt -88.75 5.92 41.12 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 122.023 0.916 . . . . 0.0 110.139 179.762 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 122.104 0.954 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -66.03 -26.33 67.47 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.368 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -5.99 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -33.49 62.8 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.121 -0.987 . . . . 0.0 109.203 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -69.62 -34.03 73.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -47.75 70.03 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.335 178.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 14.5 p -56.87 -34.71 68.1 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . 0.422 HG23 ' HB ' ' A' ' 781' ' ' ILE . 0.3 OUTLIER -52.71 -23.71 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.766 178.138 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -21.63 59.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 4.0 pp -55.16 -23.52 21.9 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 121.274 0.559 . . . . 0.0 109.543 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 7.7 t -55.47 -53.98 30.3 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -72.64 -21.5 61.09 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.692 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.98 -20.6 34.65 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.745 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.6 -42.19 98.51 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 117.936 0.868 . . . . 0.0 109.801 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 15.7 tp -68.39 -47.31 67.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.977 0.894 . . . . 0.0 110.278 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -66.95 -34.19 77.22 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.784 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.6 -45.26 89.52 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.918 -0.489 . . . . 0.0 111.815 -176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 4.1 mp -72.08 -35.1 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.19 -30.8 69.08 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.59 -45.4 77.42 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 120.734 -1.229 . . . . 0.0 109.271 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.67 -46.19 63.68 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 44.9 mt -69.77 -46.24 66.24 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -177.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -49.97 75.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 20.1 p -73.28 -38.33 65.96 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.635 0.731 . . . . 0.0 111.268 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -53.11 46.22 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 34.8 p -98.07 -49.13 4.87 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.516 -0.74 . . . . 0.0 112.041 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 77.52 89.0 0.07 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 122.067 0.936 . . . . 0.0 111.337 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 62.62 -74.74 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.823 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 41.0 t -84.64 162.49 19.72 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.527 0.679 . . . . 0.0 111.747 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -23.18 18.01 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.631 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -67.7 -39.82 84.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 122.059 0.933 . . . . 0.0 109.004 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -58.83 -28.94 66.51 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.46 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 2.6 tt -58.55 -30.72 67.34 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 9.3 mmt-85 -59.89 -32.88 71.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.64 -48.66 66.08 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -37.8 78.27 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.3 1.048 . . . . 0.0 109.662 178.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.34 -36.37 73.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.445 -178.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 66.1 mt -73.86 -31.71 63.31 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.615 -0.678 . . . . 0.0 112.236 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 8.3 pt -70.35 -37.29 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.541 -0.725 . . . . 0.0 111.305 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 35.5 m -66.08 -40.21 86.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.271 -0.893 . . . . 0.0 110.936 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.4 t -63.68 -47.41 81.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.803 -0.561 . . . . 0.0 112.081 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.7 82.1 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.699 -0.626 . . . . 0.0 111.695 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.97 -43.59 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 O-C-N 122.088 -0.383 . . . . 0.0 111.32 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 18.8 m -59.48 -38.24 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.48 -0.762 . . . . 0.0 109.8 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.32 -42.9 99.43 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.599 0.714 . . . . 0.0 109.674 179.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.62 -42.43 95.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.332 0.586 . . . . 0.0 110.832 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 10.9 tp -82.15 -14.58 55.47 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.041 0.448 . . . . 0.0 111.924 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -53.52 -44.2 67.45 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -75.32 141.67 43.35 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 122.296 -0.532 . . . . 0.0 109.977 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.851 -179.78 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 120.528 0.204 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 18.4 mt 59.96 120.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.668 0.747 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -173.2 172.18 3.91 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.721 0.772 . . . . 0.0 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -51.39 69.64 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 122.079 0.942 . . . . 0.0 109.448 179.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -72.66 -16.64 61.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.759 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 tmtt? -81.08 -46.36 15.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.262 0.553 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -62.18 -46.34 89.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.241 0.543 . . . . 0.0 110.878 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.39 -22.09 66.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.982 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.7 -32.92 73.07 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.975 -0.453 . . . . 0.0 111.434 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.3 -34.16 77.5 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.194 0.521 . . . . 0.0 111.864 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.86 -26.77 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.983 0.421 . . . . 0.0 111.043 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -77.14 -31.75 55.85 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.942 0.401 . . . . 0.0 111.604 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.4 m0 -55.24 -42.65 73.71 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.542 0.687 . . . . 0.0 110.357 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 7.4 t80 55.49 34.58 23.34 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.218 0.532 . . . . 0.0 111.484 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -148.83 -73.7 0.18 Allowed 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.65 -0.656 . . . . 0.0 112.032 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . 0.415 HG23 HD13 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -37.15 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.489 0.661 . . . . 0.0 111.599 -178.708 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -51.63 -33.54 33.8 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.91 -0.494 . . . . 0.0 111.383 -178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -57.29 -49.36 76.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.625 0.726 . . . . 0.0 109.64 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -64.56 -42.15 95.86 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.087 0.47 . . . . 0.0 110.062 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 32.2 mt -66.15 -35.64 81.01 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -99.56 -19.58 16.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -176.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -88.15 -18.17 29.35 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.428 -0.795 . . . . 0.0 112.281 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.466 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.0 pt -63.16 -37.58 79.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 O-C-N 121.945 -0.472 . . . . 0.0 111.786 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -57.18 -47.41 81.3 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.294 0.568 . . . . 0.0 110.044 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -65.96 -32.17 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -61.13 -32.43 72.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.722 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 13.3 mm -61.97 -48.75 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 121.171 0.51 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.96 -41.1 91.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 90.3 mt -59.91 -37.56 72.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 42.6 t -54.7 -41.66 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.42 -42.07 74.0 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.91 -38.23 88.16 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.812 0.815 . . . . 0.0 109.302 177.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.37 -45.99 89.9 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.097 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -41.09 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.662 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.67 -32.48 78.83 Favored Glycine 0 CA--C 1.54 1.619 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.0 -37.34 66.47 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.816 0.817 . . . . 0.0 110.742 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -55.49 -28.37 54.19 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.4 tt -58.36 -35.72 55.14 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.267 -0.896 . . . . 0.0 111.603 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 12.8 p -54.26 -30.32 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 O-C-N 121.411 -0.806 . . . . 0.0 109.852 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -57.0 -31.83 65.49 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.525 -0.734 . . . . 0.0 110.52 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.22 95.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.243 1.021 . . . . 0.0 108.603 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.2 -38.74 78.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.926 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 tp -65.7 -40.04 91.88 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.183 0.593 . . . . 0.0 110.393 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -62.93 -31.99 73.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.044 0.45 . . . . 0.0 110.27 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.22 -46.8 85.27 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 122.412 1.101 . . . . 0.0 108.428 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.12 -45.95 97.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.495 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -63.37 -36.58 84.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.128 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 15.2 ttp85 -60.24 -50.04 75.24 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 121.482 -0.761 . . . . 0.0 111.37 -176.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . 0.414 HG22 ' HA ' ' A' ' 713' ' ' SER . 0.5 OUTLIER -77.67 -43.08 29.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -178.183 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.84 -44.73 92.31 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -175.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -103.92 -23.9 13.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.31 -177.3 16.44 Favored Glycine 0 CA--C 1.538 1.477 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -138.73 -43.66 0.48 Allowed 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.534 -0.98 . . . . 0.0 112.229 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 713' ' ' SER . . . . . 0.407 ' O ' ' C ' ' C' ' 714' ' ' PRO . 82.6 p -62.71 147.6 92.82 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 117.704 -1.141 . . . . 0.0 107.924 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' C' ' 713' ' ' SER . 44.8 Cg_exo -28.44 94.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.505 2.172 0 C-N-CA 122.962 2.442 . . . . 0.0 112.212 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.3 mp -69.84 -9.71 55.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.204 -1.362 . . . . 0.0 114.466 -175.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 122.29 1.043 . . . . 0.0 112.386 -178.847 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 122.133 0.968 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 24.7 tpt85 -59.38 -26.99 65.58 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.898 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -34.51 70.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 111.955 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 32.8 mtm105 -67.57 -27.84 67.28 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.97 -37.54 74.4 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.736 -0.603 . . . . 0.0 109.647 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.47 -43.2 67.04 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 121.502 0.668 . . . . 0.0 109.615 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -58.74 -38.12 77.7 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 121.895 -0.503 . . . . 0.0 110.914 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -56.75 -20.0 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -59.57 -25.07 64.26 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.589 -0.694 . . . . 0.0 109.494 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 mt -55.92 -28.8 58.48 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 122.254 -0.279 . . . . 0.0 111.512 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 85.2 t -55.43 -54.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -73.08 -26.91 61.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.331 1.062 . . . . 0.0 109.074 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.29 -20.9 38.15 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.054 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 47.8 m -58.74 -37.85 77.09 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.834 0.817 . . . . 0.0 109.379 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.53 -51.18 38.05 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.721 0.772 . . . . 0.0 109.994 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.58 78.0 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.77 -45.45 89.77 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.768 -0.583 . . . . 0.0 110.785 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . 0.414 HG23 HD12 ' C' ' 756' ' ' ILE . 41.8 mm -69.88 -33.35 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 110.278 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.38 -31.14 69.35 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -55.81 -47.01 77.9 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.064 -1.022 . . . . 0.0 109.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.29 -45.36 66.47 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.991 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 27.3 mt -66.35 -45.45 80.15 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -66.43 -48.78 68.93 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.865 -0.522 . . . . 0.0 112.102 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.1 t -64.94 -45.29 86.4 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 110.759 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . 0.409 ' O ' ' HG ' ' C' ' 774' ' ' LEU . 1.0 OUTLIER -68.34 -54.54 16.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.843 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.89 -47.48 5.54 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.124 -0.985 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' C' ' 766' ' ' PHE . 1.6 tt 72.84 129.91 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -178.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' C' ' 765' ' ' LEU . 32.9 t80 -9.05 123.53 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.902 1.281 . . . . 0.0 114.359 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 767' ' ' SER . . . . . 0.435 ' O ' ' C ' ' C' ' 768' ' ' TYR . 1.3 m 48.94 91.26 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.57 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' C' ' 770' ' ' ARG . 41.3 m-85 3.87 -97.86 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.691 1.197 . . . . 0.0 113.609 -179.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 39.59 -76.96 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.925 0.784 . . . . 0.0 113.103 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . 0.575 ' N ' ' O ' ' C' ' 768' ' ' TYR . 32.1 mmt180 -55.3 -29.01 57.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.465 0.706 . . . . 0.0 110.528 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.22 -38.15 79.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.671 -0.643 . . . . 0.0 109.452 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -38.82 72.94 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -69.32 -34.51 74.78 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.978 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' C' ' 763' ' ' LEU . 3.5 tm? -58.4 -42.61 87.52 Favored 'General case' 0 C--N 1.355 0.813 0 O-C-N 121.759 -0.588 . . . . 0.0 109.606 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 8.3 mp -58.63 -43.05 89.57 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.921 -0.487 . . . . 0.0 111.181 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 9.9 mt -73.0 -33.24 65.65 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.107 0.479 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . 0.513 ' O ' HG12 ' C' ' 781' ' ' ILE . 0.1 OUTLIER -62.35 -37.84 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.7 -42.72 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 122.151 -0.343 . . . . 0.0 110.9 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 1.6 p -63.36 -42.12 98.88 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.229 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -31.71 71.94 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 122.051 -0.405 . . . . 0.0 111.861 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.513 HG12 ' O ' ' C' ' 777' ' ' ILE . 21.3 mm -56.23 -39.73 61.39 Favored 'Isoleucine or valine' 0 C--N 1.347 0.486 0 O-C-N 121.762 -0.586 . . . . 0.0 111.346 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.491 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 21.6 m -52.73 -37.44 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.464 -177.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.36 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 120.762 0.315 . . . . 0.0 110.436 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 175.32 129.78 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -171.65 177.81 3.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.923 0.868 . . . . 0.0 111.117 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.57 -51.1 58.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.721 0.772 . . . . 0.0 110.544 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.9 -30.51 71.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -48.15 37.22 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.406 0.622 . . . . 0.0 110.815 -179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -62.81 -46.08 89.62 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.674 0.75 . . . . 0.0 110.33 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.77 -20.2 65.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.718 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 24.7 t -71.38 -32.07 68.04 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.156 0.503 . . . . 0.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.99 -34.62 73.57 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.897 0.379 . . . . 0.0 111.061 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -59.69 -16.44 26.75 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.842 -0.536 . . . . 0.0 111.313 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -82.63 -26.16 32.48 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.361 0.6 . . . . 0.0 110.732 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -60.31 -42.07 94.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.537 0.684 . . . . 0.0 110.299 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.5 t80 60.56 35.09 20.16 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.543 0.687 . . . . 0.0 111.267 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -156.09 -66.92 0.11 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.619 -0.675 . . . . 0.0 111.652 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -65.55 -37.37 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 O-C-N 121.891 -0.506 . . . . 0.0 111.342 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.48 -34.3 48.55 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.898 -0.501 . . . . 0.0 111.986 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -63.4 -50.53 69.47 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.326 0.584 . . . . 0.0 110.261 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -66.01 -44.12 85.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 122.167 0.984 . . . . 0.0 109.53 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -35.77 77.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.949 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -101.25 -50.53 3.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -59.9 -10.35 3.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.545 -0.722 . . . . 0.0 112.645 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 pp -60.71 -36.33 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 121.657 -0.652 . . . . 0.0 110.368 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -54.63 -47.27 73.68 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.998 0.427 . . . . 0.0 110.403 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.38 -35.99 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.96 -30.51 69.15 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.122 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 12.3 mm -60.58 -50.04 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.374 0.607 . . . . 0.0 109.629 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 79.2 mt -60.84 -39.02 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.1 -36.97 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.049 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 92.7 t -54.17 -40.04 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.237 -0.914 . . . . 0.0 108.554 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.43 -39.2 92.59 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -64.72 -38.21 90.22 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.666 0.746 . . . . 0.0 109.587 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -46.18 89.05 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.502 -178.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -40.29 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.257 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.63 -28.42 67.8 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -61.98 -37.54 85.16 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.488 1.137 . . . . 0.0 109.035 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 29.7 mmt180 -55.73 -27.64 51.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.054 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 mm -58.19 -36.29 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 121.108 -0.995 . . . . 0.0 108.681 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.4 p -61.95 -30.29 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 O-C-N 121.534 -0.729 . . . . 0.0 110.572 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 6.4 m-85 -55.38 -29.07 57.76 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.865 -0.522 . . . . 0.0 110.54 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.14 -36.97 71.34 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.7 m -59.36 -36.2 62.62 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 CA-C-O 121.727 0.775 . . . . 0.0 108.967 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -60.89 -38.92 87.34 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.823 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 54.7 m -63.07 -38.86 92.89 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.762 0.792 . . . . 0.0 109.695 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -40.87 95.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 122.179 0.99 . . . . 0.0 109.312 178.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.8 t -68.56 -43.59 83.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.065 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -62.31 -41.79 98.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -66.05 -38.74 89.11 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 121.012 -1.055 . . . . 0.0 111.498 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.35 -43.96 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.955 0.883 . . . . 0.0 108.893 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -73.77 -15.73 61.19 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -87.97 -20.87 25.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.279 -0.888 . . . . 0.0 111.992 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.94 37.99 2.09 Favored Glycine 0 CA--C 1.54 1.638 0 O-C-N 121.6 -0.687 . . . . 0.0 113.094 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' NH1' ' C' ' 707' ' ' ARG . 0.6 OUTLIER 49.17 -133.49 1.5 Allowed 'General case' 0 CA--C 1.566 1.576 0 O-C-N 121.616 -0.932 . . . . 0.0 110.077 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 6.7 p -62.92 159.9 42.17 Favored Pre-proline 0 C--N 1.354 0.784 0 O-C-N 120.925 -1.11 . . . . 0.0 109.138 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -36.81 119.76 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.144 1.896 . . . . 0.0 112.877 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.35 -20.54 12.89 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 122.482 1.134 . . . . 0.0 110.589 -179.612 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 CA--C 1.536 0.437 0 CA-C-O 121.698 0.761 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -58.04 -26.56 62.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.385 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.27 -37.01 74.13 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.695 -0.628 . . . . 0.0 112.133 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . 0.471 ' HD3' ' HB2' ' C' ' 762' ' ' SER . 0.1 OUTLIER -59.2 -46.39 88.54 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.777 -0.577 . . . . 0.0 112.363 -179.051 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -59.46 -44.77 92.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.577 -177.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.84 71.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.931 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 9.2 p -59.82 -42.52 93.68 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 122.113 -0.367 . . . . 0.0 111.438 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . 0.426 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 21.9 mt -65.63 -46.64 88.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-O 116.771 -1.585 . . . . 0.0 113.66 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.452 ' C ' ' N ' ' A' ' 749' ' ' VAL . 0.1 OUTLIER -67.59 -5.0 13.42 Favored 'General case' 0 C--N 1.351 0.663 0 CA-C-N 122.204 2.275 . . . . 0.0 109.989 -178.862 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -54.9 -15.13 1.76 Allowed 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.452 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.304 1.3 t -53.1 -53.95 19.77 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 175.087 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.424 HD21 ' H ' ' A' ' 750' ' ' ASN . 1.2 m-80 -72.39 -30.22 64.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 113.999 -1.455 . . . . 0.0 107.727 174.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.71 -19.21 27.36 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 96.0 p -57.28 -36.87 71.57 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.3 -49.21 77.93 Favored 'General case' 0 C--N 1.346 0.457 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 176.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.0 73.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.735 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -59.21 -42.58 91.28 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.857 -0.527 . . . . 0.0 111.239 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 66.1 mt -61.61 -35.68 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.96 -30.61 69.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.199 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.7 -49.22 73.59 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.566 -0.709 . . . . 0.0 109.58 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.75 -43.73 68.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.873 0.844 . . . . 0.0 110.388 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -32.39 70.51 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.924 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -82.27 -31.14 30.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -177.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 35.8 t -66.46 -46.61 75.81 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.397 -0.814 . . . . 0.0 112.766 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -55.05 11.52 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 121.661 -0.649 . . . . 0.0 112.406 -179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 4.5 p -98.26 -49.13 4.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.685 0.755 . . . . 0.0 112.959 -177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 83.76 -70.26 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.663 0.785 . . . . 0.0 110.636 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -128.72 -58.25 1.17 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.792 -0.568 . . . . 0.0 111.051 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.4 m -92.2 132.15 36.87 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.081 0.467 . . . . 0.0 110.126 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . 0.416 ' CZ ' HD23 ' A' ' 771' ' ' LEU . 1.7 t80 -61.77 -13.0 19.67 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.121 -0.362 . . . . 0.0 111.413 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -37.56 87.99 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.926 0.87 . . . . 0.0 108.995 178.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -29.27 59.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.578 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . 0.416 HD23 ' CZ ' ' A' ' 768' ' ' TYR . 24.4 tp -58.97 -39.44 81.73 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 41.5 mtp180 -66.93 -32.96 74.56 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.54 -45.68 74.99 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.679 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.97 -42.29 89.58 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.38 -38.53 91.51 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.689 -0.632 . . . . 0.0 111.005 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.75 -43.96 57.57 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 121.944 -0.473 . . . . 0.0 112.013 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.68 -37.45 77.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.048 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 41.1 t -56.29 -46.17 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 121.791 -0.568 . . . . 0.0 109.706 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 68.8 p -63.52 -46.01 88.01 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.835 -0.541 . . . . 0.0 112.067 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -31.79 72.37 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 56.4 mt -54.77 -36.41 36.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.583 -0.698 . . . . 0.0 110.55 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 13.1 m -54.2 -38.39 38.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 121.23 -0.919 . . . . 0.0 109.753 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.34 -49.22 78.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.626 0.726 . . . . 0.0 110.774 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 31.3 tp -70.01 -42.48 72.94 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.264 0.554 . . . . 0.0 111.92 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 121.021 0.439 . . . . 0.0 111.703 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 61.77 115.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.524 0.678 . . . . 0.0 110.327 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -179.72 170.99 1.23 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . 0.403 ' CD1' ' HB2' ' C' ' 660' ' ' LEU . 32.8 tp -64.22 -40.75 96.7 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 121.473 0.654 . . . . 0.0 110.498 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.13 -24.15 67.76 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.379 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -81.26 -43.21 19.53 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -62.02 -46.79 87.64 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 122.006 0.908 . . . . 0.0 110.607 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.22 65.45 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.618 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 7.1 t -72.31 -29.22 63.65 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.819 0.342 . . . . 0.0 111.389 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.91 -32.73 71.03 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 122.185 -0.322 . . . . 0.0 111.179 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -59.66 -20.38 55.76 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.769 -0.582 . . . . 0.0 111.197 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -88.0 -20.41 25.87 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.169 0.509 . . . . 0.0 111.341 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -72.55 -46.7 53.18 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.099 0.476 . . . . 0.0 111.127 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 67.7 t80 58.66 19.86 7.19 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.379 0.609 . . . . 0.0 111.314 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -130.53 -67.72 0.72 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 121.378 -0.826 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -68.27 -37.11 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.891 0.377 . . . . 0.0 110.92 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.15 -33.92 42.42 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.232 -0.293 . . . . 0.0 111.775 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -63.79 -50.35 69.35 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 109.883 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -65.97 -43.08 88.94 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 121.751 0.786 . . . . 0.0 109.754 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -35.75 82.1 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 8.9 t90 -103.93 -26.68 12.56 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -82.24 -10.48 59.11 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.513 -0.742 . . . . 0.0 111.761 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.493 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 4.7 pt -60.85 -36.33 70.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.824 -0.548 . . . . 0.0 110.793 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.5 ttt-85 -53.32 -47.39 69.33 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.925 0.393 . . . . 0.0 110.4 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.7 -35.58 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.03 -29.46 68.52 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.18 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 17.6 mm -60.79 -48.28 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.211 0.529 . . . . 0.0 110.277 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.44 -43.17 94.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 89.4 mt -58.85 -37.71 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . 0.416 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 46.6 t -62.2 -48.77 86.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.5 -27.1 11.12 Favored Glycine 0 CA--C 1.54 1.613 0 O-C-N 121.772 -0.58 . . . . 0.0 111.896 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.0 m -60.61 -39.68 89.07 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.416 ' CD1' ' O ' ' B' ' 689' ' ' VAL . 0.3 OUTLIER -59.62 -32.7 70.66 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.235 -0.916 . . . . 0.0 111.643 -177.619 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.87 -46.96 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.45 -27.39 67.78 Favored Glycine 0 CA--C 1.542 1.737 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 178.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -37.16 67.37 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.758 0.789 . . . . 0.0 110.458 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -55.18 -27.99 49.78 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -36.44 58.1 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 O-C-N 120.792 -1.193 . . . . 0.0 109.465 -177.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.0 p -66.99 -30.25 48.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.477 -0.764 . . . . 0.0 110.169 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -55.88 -30.58 61.77 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.648 -0.657 . . . . 0.0 109.652 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.57 76.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -41.98 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 176.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.08 -37.87 72.51 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.445 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 29.2 m -62.83 -37.0 85.04 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.289 0.566 . . . . 0.0 110.38 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -45.26 93.29 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 122.322 1.058 . . . . 0.0 109.137 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.8 -43.34 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.995 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.36 -36.42 82.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.568 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -63.58 -49.56 72.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 122.404 1.097 . . . . 0.0 110.764 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . 0.465 HG23 ' HA ' ' C' ' 713' ' ' SER . 1.5 t -77.16 -44.9 30.81 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 114.79 -1.095 . . . . 0.0 113.645 -177.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.25 -45.94 92.43 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' B' ' 706' ' ' ASN . 5.1 pt20 -105.77 -24.69 12.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.415 1.102 . . . . 0.0 113.644 178.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 129.63 136.34 4.05 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -73.71 -61.77 1.72 Allowed 'General case' 0 N--CA 1.477 0.913 0 O-C-N 122.002 -0.705 . . . . 0.0 112.072 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 54.9 p -66.35 159.36 73.0 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.632 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -32.5 131.78 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.31 2.007 . . . . 0.0 112.825 -179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . 0.406 ' O ' ' C ' ' B' ' 716' ' ' SER . 7.6 tt -93.74 -20.42 20.15 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -176.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 716' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 715' ' ' LEU . 2.8 t . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 122.17 0.986 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 18.4 tpt85 -65.94 -26.98 67.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.575 0.703 . . . . 0.0 111.275 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -60.83 -6.7 1.9 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -55.73 -39.63 71.39 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.517 -0.739 . . . . 0.0 111.195 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -58.02 -39.69 78.97 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.655 -0.653 . . . . 0.0 109.74 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -68.01 -38.85 83.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.3 p -59.7 -44.68 93.57 Favored 'General case' 0 N--CA 1.462 0.175 0 O-C-N 121.963 -0.461 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.2 mp -55.17 -19.45 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.418 177.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -59.89 -26.63 66.04 Favored 'General case' 0 C--N 1.346 0.428 0 O-C-N 121.594 -0.691 . . . . 0.0 109.437 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -55.49 -20.4 12.7 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 65.2 t -57.43 -54.22 33.84 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 176.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -72.94 -18.0 61.43 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.211 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.06 -20.68 35.56 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.915 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 23.1 p -58.76 -38.05 77.6 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.031 0.916 . . . . 0.0 109.685 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.91 -49.98 58.83 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.243 0.544 . . . . 0.0 110.029 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.52 78.61 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.98 -45.53 88.64 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.582 -0.699 . . . . 0.0 111.604 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 55.9 mt -67.01 -38.59 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 121.835 0.826 . . . . 0.0 109.484 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.01 67.96 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.587 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -55.15 -49.35 72.03 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.734 -1.229 . . . . 0.0 110.05 -178.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.25 -46.36 61.18 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.18 -46.83 63.81 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -63.85 -37.82 88.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.37 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 84.5 p -70.44 -45.17 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.52 0.676 . . . . 0.0 110.957 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -53.7 52.13 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.926 0.714 . . . . 0.0 112.926 -178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.6 p -98.5 -11.82 21.89 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -177.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.41 -154.62 0.34 Allowed 'General case' 0 CA--C 1.552 1.023 0 O-C-N 121.206 -0.934 . . . . 0.0 108.54 -177.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -48.93 -72.61 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.36 -0.837 . . . . 0.0 111.529 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 87.6 p -80.34 177.2 9.13 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.707 -0.621 . . . . 0.0 111.334 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.42 -31.98 13.13 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.978 -0.451 . . . . 0.0 110.722 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -53.89 -35.18 61.32 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.522 0.677 . . . . 0.0 109.854 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -29.57 60.33 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.66 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -59.44 -35.45 74.04 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 121.934 -0.479 . . . . 0.0 110.103 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -39.24 90.63 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -69.18 -45.18 70.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.337 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -37.9 89.04 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.958 0.885 . . . . 0.0 110.564 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -58.75 -36.66 74.72 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.381 0.61 . . . . 0.0 110.539 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.27 -35.61 73.86 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.59 -0.694 . . . . 0.0 112.152 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 21.7 pt -70.29 -37.09 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 O-C-N 121.688 -0.632 . . . . 0.0 111.325 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 3.4 m -61.9 -39.48 83.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 121.132 -0.98 . . . . 0.0 109.857 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 779' ' ' THR . . . . . 0.465 ' O ' HG23 ' B' ' 782' ' ' VAL . 20.4 p -63.69 -47.32 81.66 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.929 -0.482 . . . . 0.0 112.2 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -33.25 74.15 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.405 -0.809 . . . . 0.0 111.269 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 71.0 mt -66.12 -44.57 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.8 -0.563 . . . . 0.0 111.834 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 779' ' ' THR . 24.8 m -59.3 -38.1 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.471 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -57.41 -44.25 84.43 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.798 0.809 . . . . 0.0 109.82 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 25.6 tp -69.98 -43.46 71.44 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.871 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.03 -25.23 67.75 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.964 -0.46 . . . . 0.0 111.15 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -36.17 -47.96 1.1 Allowed Glycine 0 CA--C 1.536 1.363 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.75 97.44 8.08 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.686 -179.076 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . 0.403 ' HB2' ' CD1' ' B' ' 663' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 121.576 0.703 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.32 160.28 15.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.093 0.473 . . . . 0.0 110.818 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 172.81 175.56 0.1 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.29 0.567 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -45.95 86.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.85 0.834 . . . . 0.0 109.622 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -73.3 -22.7 60.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.149 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -46.51 14.58 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.1 0.476 . . . . 0.0 111.145 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -58.8 -46.15 88.26 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.406 0.622 . . . . 0.0 109.602 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.75 -21.04 65.29 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.971 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.1 t -64.86 -35.12 80.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.987 0.423 . . . . 0.0 111.523 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.68 -36.28 76.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.132 0.491 . . . . 0.0 110.98 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -59.55 -22.15 61.29 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.3 0.571 . . . . 0.0 110.768 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -75.93 -29.26 58.29 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.457 0.646 . . . . 0.0 110.736 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -61.52 -41.66 97.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.749 0.785 . . . . 0.0 109.892 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 5.7 t80 58.87 36.03 24.46 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.027 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -160.98 -68.08 0.06 Allowed 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.571 -0.706 . . . . 0.0 112.291 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -37.22 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-O 121.472 0.653 . . . . 0.0 111.415 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -52.41 -33.67 44.81 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 122.014 -0.429 . . . . 0.0 111.444 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -56.83 -49.25 75.98 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.63 0.729 . . . . 0.0 109.745 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -65.14 -40.62 94.67 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.908 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.69 -35.89 82.07 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -92.86 -48.39 6.57 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -60.34 -21.16 61.74 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.902 -0.499 . . . . 0.0 112.086 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.1 pp -60.48 -36.5 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 O-C-N 121.713 -0.617 . . . . 0.0 110.547 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 12.4 ttt-85 -57.65 -47.14 83.09 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.244 0.545 . . . . 0.0 110.257 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.95 -33.25 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 121.67 0.747 . . . . 0.0 109.067 178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -33.99 72.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.037 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 13.0 mm -60.65 -43.48 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.45 0.643 . . . . 0.0 109.498 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -66.01 -41.65 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.25 -38.0 72.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 69.3 t -54.99 -40.42 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.08 -37.82 87.27 Favored Glycine 0 CA--C 1.531 1.058 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -67.29 -37.72 83.86 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.063 0.935 . . . . 0.0 109.465 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.24 -44.55 92.35 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.024 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -62.68 -42.05 94.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 121.242 0.544 . . . . 0.0 109.778 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.62 -33.08 80.65 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.82 -37.93 83.68 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.971 0.891 . . . . 0.0 109.839 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -56.09 -28.3 57.14 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.6 tt -58.44 -36.02 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.258 -0.901 . . . . 0.0 111.206 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.5 p -54.43 -30.18 21.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 121.425 -0.797 . . . . 0.0 110.219 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -56.39 -31.3 63.72 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.822 -0.549 . . . . 0.0 110.293 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.65 82.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -68.72 -42.52 83.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.82 -38.14 84.4 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.496 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.0 m -66.76 -37.12 83.99 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.424 0.631 . . . . 0.0 110.088 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -42.32 97.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.954 0.883 . . . . 0.0 108.821 178.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.0 t -65.08 -45.54 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 122.546 1.165 . . . . 0.0 108.716 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.85 -35.89 81.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.015 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . 0.412 ' NH1' ' CZ ' ' A' ' 712' ' ' TYR . 0.0 OUTLIER -62.56 -49.58 74.72 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 121.685 -0.635 . . . . 0.0 111.336 -177.11 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.0 p -77.47 -44.41 29.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.527 0.68 . . . . 0.0 112.331 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -73.97 -33.11 63.74 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -101.56 -17.68 16.27 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 113.048 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.84 169.87 14.91 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -120.96 -48.56 2.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.217 -0.578 . . . . 0.0 110.962 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 713' ' ' SER . . . . . 0.465 ' HA ' HG23 ' B' ' 708' ' ' VAL . 25.7 p -106.69 157.98 33.86 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.615 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -38.14 96.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.803 0 C-N-CA 121.913 1.742 . . . . 0.0 111.912 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' C' ' 716' ' ' SER . 28.1 tp -73.41 -20.68 60.67 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 716' ' ' SER . . . . . 0.469 ' C ' ' O ' ' C' ' 715' ' ' LEU . 3.2 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.079 0.943 . . . . 0.0 113.04 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.908 0.861 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 tpt85 -71.86 -26.85 62.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.563 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -38.92 84.91 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.24 0.543 . . . . 0.0 110.803 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -62.5 -36.39 82.39 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.102 -0.374 . . . . 0.0 111.319 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -58.46 -39.93 81.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.484 . . . . 0.0 110.102 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.59 -49.33 41.49 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.137 0.494 . . . . 0.0 110.798 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -33.83 67.04 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.012 -0.43 . . . . 0.0 110.699 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -24.43 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 O-C-N 121.469 -0.769 . . . . 0.0 109.095 178.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -59.37 -21.49 59.94 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.62 -27.21 48.31 Favored 'General case' 0 C--N 1.348 0.519 0 O-C-N 122.128 -0.358 . . . . 0.0 110.748 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 90.0 t -55.52 -54.08 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -72.42 -25.8 61.62 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.33 175.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.59 -20.96 40.67 Favored Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.705 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.0 m -59.98 -37.95 81.11 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.752 -0.852 . . . . 0.0 109.386 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.6 tp -66.7 -51.2 58.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.418 0.628 . . . . 0.0 109.889 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.0 79.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.584 0.707 . . . . 0.0 111.365 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.1 tt -59.4 -45.45 91.46 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 -178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.25 -35.04 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.64 0.733 . . . . 0.0 109.325 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.14 68.1 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.471 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -55.36 -46.61 76.46 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.069 -1.019 . . . . 0.0 109.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.69 -45.48 64.93 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.15 -44.0 73.19 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -61.39 -49.8 75.46 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 762' ' ' SER . . . . . 0.471 ' HB2' ' HD3' ' A' ' 742' ' ' ARG . 1.7 p -66.15 -45.31 81.41 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.542 -0.724 . . . . 0.0 110.8 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . 0.439 ' HA ' ' HG ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -59.72 -54.38 47.08 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 -178.408 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.86 -48.72 4.81 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 85.97 -78.61 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -124.59 -86.89 0.63 Allowed 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.483 -0.761 . . . . 0.0 111.337 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 83.4 p -90.13 167.28 12.85 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.56 -0.713 . . . . 0.0 110.225 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.12 -16.18 63.6 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.949 0.404 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -71.12 -44.03 66.42 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -62.69 -30.65 71.55 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.335 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.54 -30.49 69.79 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.828 -0.545 . . . . 0.0 109.86 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -57.25 -38.44 73.83 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.167 -0.333 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.29 -39.2 93.9 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.739 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . 0.439 ' HG ' ' HA ' ' C' ' 763' ' ' LEU . 0.2 OUTLIER -67.39 -38.17 84.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 121.772 0.796 . . . . 0.0 109.872 178.498 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.42 -36.27 73.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.81 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -70.56 -29.68 66.2 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.536 -0.727 . . . . 0.0 110.405 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . 0.41 ' O ' ' HB ' ' C' ' 781' ' ' ILE . 48.2 mt -60.77 -39.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.346 0.415 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.153 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 15.0 m -55.5 -43.83 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 119.067 0.849 . . . . 0.0 113.013 -175.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 2.4 p -64.28 -48.21 76.56 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.107 -0.995 . . . . 0.0 111.615 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -29.13 68.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . 0.496 HG22 ' N ' ' C' ' 782' ' ' VAL . 0.1 OUTLIER -52.98 -36.55 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.6 -175.534 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.496 ' N ' HG22 ' C' ' 781' ' ' ILE . 34.5 m -53.41 -37.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 119.11 -1.036 . . . . 0.0 112.092 -177.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.675 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 6.8 tp . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 48.2 mt 56.82 90.08 0.04 OUTLIER 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.994 0.902 . . . . 0.0 110.267 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -161.7 -177.34 5.82 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.519 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.31 -40.68 62.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.201 0.525 . . . . 0.0 110.512 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -36.02 65.92 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -178.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -43.54 56.95 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.387 0.613 . . . . 0.0 111.075 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -74.0 -45.83 47.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.406 -179.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.52 -35.86 82.13 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.137 0.494 . . . . 0.0 111.337 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -32.79 68.48 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.319 0.58 . . . . 0.0 110.886 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -24.1 67.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.828 0.347 . . . . 0.0 111.487 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -67.95 -19.57 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.003 -0.436 . . . . 0.0 111.688 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -80.88 -17.81 49.36 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.046 0.45 . . . . 0.0 111.508 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.72 -47.98 82.8 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.2 48.01 3.87 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 112.181 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.81 -71.48 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.651 -0.655 . . . . 0.0 112.235 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -66.83 -36.81 78.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 O-C-N 121.804 -0.56 . . . . 0.0 112.054 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.7 m -51.75 -33.21 33.97 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.922 -0.486 . . . . 0.0 112.037 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.38 -49.55 77.37 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.564 -0.71 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -65.78 -44.8 84.7 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.545 0.688 . . . . 0.0 110.583 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -37.43 84.81 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -89.91 -1.93 58.08 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -119.96 0.18 10.74 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.431 0.634 . . . . 0.0 110.619 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 685' ' ' PHE . 2.4 tp -61.66 -36.36 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-O 122.115 0.96 . . . . 0.0 110.112 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -59.39 -44.89 92.72 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.78 -33.66 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' A' ' 682' ' ' ILE . 0.9 OUTLIER -59.66 -33.48 71.6 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.804 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 8.4 mm -60.69 -42.42 91.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.166 0.508 . . . . 0.0 109.9 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -71.82 -39.56 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.4 mt -61.94 -40.69 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.971 -0.455 . . . . 0.0 110.6 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 63.0 t -54.49 -39.46 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.14 -36.54 82.56 Favored Glycine 0 CA--C 1.537 1.456 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.8 m -65.02 -38.16 89.99 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.816 0.817 . . . . 0.0 109.455 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.05 -46.39 88.36 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.704 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.48 -39.89 81.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.596 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.92 -20.74 54.1 Favored Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.219 -0.925 . . . . 0.0 111.014 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -36.68 82.47 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 122.128 0.965 . . . . 0.0 110.151 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 24.9 mmt180 -56.3 -30.18 62.18 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 1.4 pp -60.5 -36.64 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.542 -1.349 . . . . 0.0 108.893 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.3 t -67.16 -30.24 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 CA-C-N 115.357 -0.838 . . . . 0.0 108.933 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -27.92 52.45 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 122.871 0.468 . . . . 0.0 110.343 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.44 -36.97 69.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.4 m -59.1 -35.69 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -42.6 91.35 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 7.2 m -66.13 -41.16 90.87 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.795 0.807 . . . . 0.0 109.734 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -40.84 94.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -39.61 79.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.448 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 710' ' ' GLN . 1.1 m-80 -62.3 -36.93 83.64 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.102 0.561 . . . . 0.0 111.493 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . 0.429 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 9.0 ttm180 -62.59 -49.47 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.703 0.763 . . . . 0.0 110.252 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' B' ' 713' ' ' SER . 0.9 OUTLIER -77.04 -42.09 31.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.823 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -58.69 -41.37 86.09 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -174.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 706' ' ' ASN . 4.9 pt20 -101.97 -21.87 14.41 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -176.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 164.82 -128.11 1.74 Allowed Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.681 -0.637 . . . . 0.0 112.459 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 712' ' ' TYR . . . . . 0.464 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER -171.85 -116.84 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -178.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 713' ' ' SER . . . . . 0.464 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 7.3 m -62.83 159.4 45.36 Favored Pre-proline 0 C--N 1.352 0.687 0 O-C-N 120.641 -1.287 . . . . 0.0 109.083 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_exo -42.88 101.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.358 1.372 . . . . 0.0 111.699 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.39 -20.79 13.62 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 121.997 0.903 . . . . 0.0 111.671 -179.697 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.98 0.895 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -26.43 62.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.13 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.5 -9.94 0.57 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.8 mtm-85 -64.95 -46.36 81.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.349 -0.845 . . . . 0.0 111.208 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -63.44 -44.69 93.79 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.486 0.66 . . . . 0.0 111.685 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -71.19 -36.86 72.08 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.711 -0.618 . . . . 0.0 110.56 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 89.9 p -64.47 -42.21 96.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.759 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.95 90.08 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.872 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.188 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 747' ' ' ARG . . . . . 0.443 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.32 14.3 ttt180 -70.26 -0.02 7.23 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 116.153 -2.219 . . . . 0.0 111.699 -176.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.22 -15.5 6.03 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 169.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 749' ' ' VAL . . . . . 0.43 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.308 1.6 t -52.96 -54.37 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 750' ' ' ASN . . . . . 0.406 ' H ' HD21 ' A' ' 750' ' ' ASN . 1.6 m-80 -72.86 -26.19 61.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 122.611 1.196 . . . . 0.0 108.458 174.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.64 -19.27 27.05 Favored Glycine 0 C--N 1.341 0.831 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.822 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 11.1 p -57.23 -37.29 72.06 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.65 -47.69 84.22 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.12 -35.36 78.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.963 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -45.07 92.18 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.668 -0.645 . . . . 0.0 110.908 -177.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.7 mt -61.65 -37.75 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.62 -33.87 73.27 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.087 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -55.98 -45.11 79.06 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.823 0.82 . . . . 0.0 109.715 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.11 -41.38 74.06 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.432 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.23 -33.94 76.4 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 28.1 mtt85 -73.65 -25.8 60.45 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 60.5 p -77.02 -45.52 26.94 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.624 -0.673 . . . . 0.0 111.217 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 10.4 mp -68.39 -54.94 13.84 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.01 -49.3 4.56 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.547 0.689 . . . . 0.0 112.493 -178.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 1.1 tm? 88.62 -72.56 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.184 0.993 . . . . 0.0 109.658 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -118.67 -67.09 1.01 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.773 -0.58 . . . . 0.0 111.157 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.81 148.15 24.73 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.32 0.581 . . . . 0.0 110.842 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -62.62 -23.62 67.15 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.993 0.425 . . . . 0.0 110.878 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.868 0.842 . . . . 0.0 109.628 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -63.57 -29.82 71.02 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.482 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -45.27 92.77 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.02 -39.51 90.03 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.617 0.722 . . . . 0.0 109.322 177.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -64.64 -39.58 93.94 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.7 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.51 -38.74 81.75 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-O 121.109 0.481 . . . . 0.0 111.32 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mt -58.63 -36.99 74.95 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.786 -0.571 . . . . 0.0 111.837 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.04 -44.91 52.64 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.925 -0.484 . . . . 0.0 111.954 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 7.5 pt -64.4 -37.31 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.552 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 79.3 t -57.45 -46.74 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.521 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 37.4 p -63.84 -35.99 82.44 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.21 1.005 . . . . 0.0 110.546 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -45.46 74.28 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.349 -0.842 . . . . 0.0 112.9 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 11.6 pt -69.64 -36.77 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.39 -38.32 79.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.561 0 O-C-N 121.438 -0.789 . . . . 0.0 109.392 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -60.89 -43.47 98.44 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-O 121.545 0.688 . . . . 0.0 109.794 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.63 -39.57 84.66 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.59 0.71 . . . . 0.0 110.44 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.537 0.451 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.58 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 mm? 61.82 116.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.649 0.738 . . . . 0.0 110.529 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 177.65 178.45 0.32 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.396 0.617 . . . . 0.0 109.988 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 14.8 tp -50.97 -56.35 12.85 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 122.349 1.071 . . . . 0.0 110.71 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -20.21 65.92 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.793 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -81.15 -44.59 17.66 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.329 0.585 . . . . 0.0 110.25 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -74.91 -46.38 36.3 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.512 0.672 . . . . 0.0 111.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.82 63.39 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.559 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 54.4 p -71.58 -31.19 66.68 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.884 -0.51 . . . . 0.0 111.142 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.7 -30.72 68.99 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.09 0.472 . . . . 0.0 110.682 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -59.76 -22.9 62.74 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.06 0.457 . . . . 0.0 111.048 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.92 -24.92 23.47 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.148 0.499 . . . . 0.0 111.453 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.93 -51.61 66.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.281 0.562 . . . . 0.0 111.255 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 57.53 37.59 27.7 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.876 0.846 . . . . 0.0 110.724 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -140.06 -80.5 0.28 Allowed 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.843 -0.535 . . . . 0.0 110.461 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tt -68.2 -35.78 72.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 121.657 -0.652 . . . . 0.0 111.156 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -50.53 -33.41 21.52 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 121.982 -0.449 . . . . 0.0 111.716 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.72 -49.95 75.43 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -41.58 91.41 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 121.895 0.855 . . . . 0.0 109.591 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.22 -35.98 80.55 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -177.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -106.85 -26.31 11.3 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -79.57 -11.83 59.87 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.483 -0.761 . . . . 0.0 111.898 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.448 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 5.6 pt -60.66 -36.2 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.919 -0.488 . . . . 0.0 110.322 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -52.88 -47.35 67.93 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.29 -0.256 . . . . 0.0 110.682 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.66 -36.11 68.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.9 -29.39 68.32 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.967 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 14.4 mm -61.21 -45.72 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 O-C-N 121.79 -0.569 . . . . 0.0 109.614 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 64.7 mt -65.63 -42.5 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.86 -37.78 68.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.85 -48.88 86.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.76 -27.33 12.69 Favored Glycine 0 CA--C 1.541 1.693 0 O-C-N 121.691 -0.631 . . . . 0.0 112.054 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.1 m -60.65 -42.3 96.7 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . 0.413 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.33 -32.75 70.37 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.457 -0.777 . . . . 0.0 112.108 -177.3 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.413 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.86 -47.83 85.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 O-C-N 121.704 -0.622 . . . . 0.0 109.618 -178.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.36 -32.83 84.25 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -53.91 -36.43 62.72 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.287 1.042 . . . . 0.0 110.031 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 25.8 mmt180 -55.02 -27.63 45.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 124.104 0.961 . . . . 0.0 112.505 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . 0.408 HD12 HG21 ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.33 -36.1 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 O-C-N 120.832 -1.168 . . . . 0.0 108.844 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.7 p -64.51 -30.81 51.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.422 -0.799 . . . . 0.0 109.967 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.9 m-85 -56.65 -31.01 63.97 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.833 -0.542 . . . . 0.0 109.681 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.93 -37.52 76.89 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -41.57 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 176.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.9 tp -58.39 -39.12 78.8 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.825 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 50.2 m -64.07 -36.62 84.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.436 0.636 . . . . 0.0 109.813 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -43.28 99.19 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.28 1.038 . . . . 0.0 109.136 178.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 93.8 t -69.82 -45.47 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.717 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . 0.469 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 7.6 m-20 -62.92 -39.64 95.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.404 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -48.59 60.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 0.0 111.401 -177.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -42.55 34.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -176.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.53 -45.24 94.57 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' B' ' 706' ' ' ASN . 5.5 pt20 -104.84 -24.54 12.87 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 144.5 160.18 8.39 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -100.79 -70.64 0.73 Allowed 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.731 -0.864 . . . . 0.0 112.795 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 713' ' ' SER . . . . . 0.431 ' HA ' HG22 ' A' ' 708' ' ' VAL . 1.6 m -63.24 159.46 48.62 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.717 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 714' ' ' PRO . . . . . 0.411 ' C ' ' O ' ' B' ' 713' ' ' SER . 3.7 Cg_exo -28.44 108.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 122.651 2.234 . . . . 0.0 112.614 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.6 tt -75.94 -11.91 60.05 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 122.159 0.98 . . . . 0.0 111.942 -178.723 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 31.3 tp10 . . . . . 0 N--CA 1.464 0.249 0 CA-C-O 121.798 0.809 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -30.16 65.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.266 -178.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.0 -8.39 2.29 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -35.66 80.77 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.538 -0.726 . . . . 0.0 111.13 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -58.74 -42.39 88.67 Favored 'General case' 0 C--N 1.344 0.33 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -71.43 -35.56 70.98 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.834 177.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.2 m -57.1 -37.73 72.35 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.065 -0.397 . . . . 0.0 110.227 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.4 mp -55.68 -17.69 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.564 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.52 -29.66 68.04 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 12.7 tp -55.7 -18.54 8.32 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.082 0.468 . . . . 0.0 110.05 178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 42.5 t -55.69 -53.34 38.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.658 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -71.96 -18.87 61.96 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.795 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.16 -20.46 35.54 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.053 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 67.5 p -58.6 -38.14 77.34 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.849 -0.795 . . . . 0.0 109.408 179.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.84 -50.73 63.55 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.461 0.648 . . . . 0.0 109.62 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.84 -35.53 81.43 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.3 tt -59.84 -45.51 92.2 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.794 -0.567 . . . . 0.0 110.756 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.29 -37.78 80.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.652 0.739 . . . . 0.0 109.178 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.08 -30.31 68.6 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.342 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -55.58 -49.79 71.8 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.844 -1.16 . . . . 0.0 109.281 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.67 -45.89 60.58 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.42 0.628 . . . . 0.0 112.45 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 -46.72 65.37 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 8.9 ttm-85 -64.26 -49.94 69.91 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -177.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 3.0 m -62.27 -43.56 98.55 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.999 -0.438 . . . . 0.0 111.684 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.89 -53.84 52.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 60.2 p -98.06 -49.24 4.83 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.396 0.617 . . . . 0.0 112.348 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 24.6 tp 69.15 102.92 0.06 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.867 0.842 . . . . 0.0 110.333 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 42.6 t80 64.6 -77.93 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.925 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 20.0 m -95.73 151.82 19.02 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.597 -0.689 . . . . 0.0 111.356 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.26 -30.88 43.28 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.864 0.364 . . . . 0.0 110.5 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -53.34 -40.44 64.9 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.92 0.867 . . . . 0.0 109.357 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.1 tpt85 -58.24 -29.49 65.79 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.578 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.95 -34.96 72.38 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -64.14 -35.03 79.46 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.98 -46.95 73.06 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 774' ' ' LEU . . . . . 0.417 ' O ' HG13 ' B' ' 777' ' ' ILE . 1.5 tt -63.25 -37.98 89.37 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.953 0.882 . . . . 0.0 110.264 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.97 -37.06 81.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.836 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.48 -44.86 63.95 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.931 -0.481 . . . . 0.0 111.688 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 777' ' ' ILE . . . . . 0.417 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.7 pp -64.5 -36.97 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.734 -0.604 . . . . 0.0 109.49 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 51.8 t -57.31 -46.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 O-C-N 121.678 -0.639 . . . . 0.0 111.028 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 5.8 t -63.5 -35.57 80.88 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.557 -0.714 . . . . 0.0 112.158 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -31.5 71.81 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.68 -0.638 . . . . 0.0 111.308 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 79.8 mt -60.42 -42.69 91.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.081 -0.387 . . . . 0.0 111.585 -178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.7 m -54.93 -38.81 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.334 -0.854 . . . . 0.0 110.061 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.32 -45.56 92.68 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.596 0.713 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 17.5 tp -66.12 -43.97 85.6 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.293 0.568 . . . . 0.0 111.078 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 4.2 tp -77.12 -16.47 59.16 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.074 0.464 . . . . 0.0 111.273 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.3 -48.11 15.91 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.88 106.99 19.38 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.524 -179.467 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 121.496 0.665 . . . . 0.0 109.286 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 6.8 mp 60.68 120.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.621 0.725 . . . . 0.0 111.555 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.55 169.21 3.13 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.426 0.631 . . . . 0.0 110.059 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -52.07 66.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.763 0.792 . . . . 0.0 109.679 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.71 -17.15 61.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.853 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -81.07 -44.26 18.27 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.027 0.441 . . . . 0.0 111.189 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -63.95 -46.28 85.41 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.45 0.643 . . . . 0.0 110.284 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.48 -26.53 68.76 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.533 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -63.75 -37.97 89.37 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.047 0.451 . . . . 0.0 111.723 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.18 -34.78 74.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.869 0.366 . . . . 0.0 111.629 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -59.67 -21.96 61.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.036 0.446 . . . . 0.0 111.285 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -79.61 -24.54 41.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.173 0.511 . . . . 0.0 111.26 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -58.77 -37.63 76.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.507 0.67 . . . . 0.0 110.352 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 59.09 27.48 16.45 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.008 178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.71 -68.81 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.548 -0.72 . . . . 0.0 112.227 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -37.93 64.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.517 0.675 . . . . 0.0 111.083 -178.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.54 -33.84 47.36 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.958 -0.463 . . . . 0.0 111.149 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -62.95 -50.03 72.42 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.037 0.446 . . . . 0.0 110.343 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -65.69 -44.2 86.92 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.284 0.564 . . . . 0.0 109.801 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -35.76 82.01 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -95.51 -33.52 12.4 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -75.36 -16.37 60.39 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.788 -0.57 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 pp -60.54 -36.77 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.877 -0.514 . . . . 0.0 110.304 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -57.04 -47.34 81.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.216 0.531 . . . . 0.0 110.005 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.81 -35.73 75.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -32.03 70.26 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.867 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 9.6 mm -60.86 -49.51 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.327 0.584 . . . . 0.0 109.95 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -65.27 -36.94 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.8 -37.94 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 73.5 t -55.73 -39.99 58.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.18 -40.32 91.44 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 9.8 m -63.26 -39.41 94.53 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 122.167 0.984 . . . . 0.0 109.817 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -46.15 89.2 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.318 -177.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.85 -42.12 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.51 -32.28 77.4 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -58.22 -38.41 76.74 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.997 0.903 . . . . 0.0 109.645 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -55.95 -28.13 55.6 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.8 tt -58.06 -36.35 56.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 120.924 -1.11 . . . . 0.0 111.141 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 13.9 p -54.86 -29.51 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 121.402 -0.812 . . . . 0.0 109.375 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.43 -31.58 64.06 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.171 -0.956 . . . . 0.0 109.619 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.01 97.41 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 52.7 t -68.33 -36.24 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.698 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.82 -37.03 82.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.366 0.667 . . . . 0.0 109.773 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.6 m -62.19 -36.45 81.95 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.219 0.533 . . . . 0.0 110.518 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -41.35 97.91 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 122.153 0.977 . . . . 0.0 108.708 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.58 -44.53 93.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-O 122.176 0.988 . . . . 0.0 108.952 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.35 -35.88 80.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.333 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -49.69 75.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 121.685 -0.634 . . . . 0.0 110.532 -178.126 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -44.67 32.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.435 0.636 . . . . 0.0 111.766 -178.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -73.36 -39.85 64.84 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.377 -178.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -102.67 -18.89 15.0 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 102.31 171.11 27.08 Favored Glycine 0 CA--C 1.536 1.348 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.1 p90 -119.13 -54.29 2.22 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.681 -0.893 . . . . 0.0 112.297 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 87.6 p -94.44 159.42 33.84 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-O 118.752 -0.642 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -39.55 103.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.668 1.579 . . . . 0.0 111.749 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 715' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' C' ' 716' ' ' SER . 27.7 tp -85.81 -19.89 30.0 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 716' ' ' SER . . . . . 0.479 ' C ' ' O ' ' C' ' 715' ' ' LEU . 35.5 t . . . . . 0 N--CA 1.5 2.052 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.58 0.705 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -61.7 -33.26 73.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.346 0.593 . . . . 0.0 111.088 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -58.32 -38.23 76.7 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.113 0.482 . . . . 0.0 110.95 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -63.24 -42.67 99.23 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 122.175 -0.328 . . . . 0.0 111.153 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -58.03 -38.42 76.2 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.41 0.624 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -71.1 -42.54 69.17 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.375 0.607 . . . . 0.0 109.573 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.28 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.123 -0.361 . . . . 0.0 111.051 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.58 -21.0 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 120.039 -0.664 . . . . 0.0 109.717 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -59.67 -28.13 66.99 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.359 -0.838 . . . . 0.0 109.074 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.98 -24.49 39.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 53.8 t -55.59 -54.6 24.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -72.9 -26.76 61.54 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.094 0.95 . . . . 0.0 109.233 174.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.32 -20.83 38.12 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.241 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 74.7 m -60.51 -38.02 83.0 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.919 -0.754 . . . . 0.0 109.429 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.61 -50.1 54.12 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.352 0.596 . . . . 0.0 110.159 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.71 80.24 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -60.38 -45.46 93.46 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.311 0.577 . . . . 0.0 110.383 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 54.5 mt -65.62 -36.91 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.894 0.854 . . . . 0.0 108.717 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.22 -30.6 68.79 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.933 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -55.56 -46.01 77.22 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.571 -0.706 . . . . 0.0 110.244 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.25 -41.9 72.91 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.283 0.563 . . . . 0.0 110.987 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -33.34 75.5 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -81.95 -38.93 24.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -44.52 61.89 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.246 -0.909 . . . . 0.0 109.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.23 -53.66 45.63 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.502 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 46.6 t -97.81 -49.24 4.89 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.529 -0.732 . . . . 0.0 112.496 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.17 98.53 0.07 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 122.036 0.922 . . . . 0.0 110.914 -178.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 62.9 t80 48.88 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.417 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 20.3 t -73.9 154.01 39.59 Favored 'General case' 0 C--N 1.346 0.418 0 O-C-N 121.325 -0.859 . . . . 0.0 110.598 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.24 -19.46 58.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.93 0.395 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -43.72 88.37 Favored 'General case' 0 C--N 1.345 0.375 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.5 mmt-85 -58.73 -30.77 67.72 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.487 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.67 -32.6 71.79 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.08 0.467 . . . . 0.0 109.842 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.31 -37.78 70.39 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -63.98 -34.72 78.64 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.64 -38.68 78.62 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-O 121.074 0.464 . . . . 0.0 110.355 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.24 -43.25 92.39 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.564 0.697 . . . . 0.0 110.623 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 50.3 mt -74.34 -34.7 63.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.603 0.716 . . . . 0.0 110.182 178.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.03 -43.15 95.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.523 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 34.6 m -64.93 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.191 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -48.11 78.21 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.843 -0.535 . . . . 0.0 111.784 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -31.41 71.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.143 0.497 . . . . 0.0 111.769 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 21.2 mt -57.85 -36.88 57.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 782' ' ' VAL . . . . . 0.443 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 33.9 m -53.2 -37.77 28.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.518 0 CA-C-N 119.35 0.977 . . . . 0.0 110.94 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 . . . . . 0 CA--C 1.543 0.685 0 O-C-N 121.855 -0.528 . . . . 0.0 112.074 -179.84 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 69.0 mt 57.97 116.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.981 0.896 . . . . 0.0 112.117 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -176.63 175.04 1.76 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.532 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.67 -39.87 52.17 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.504 0.668 . . . . 0.0 110.837 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -74.37 -36.07 63.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.51 0.671 . . . . 0.0 111.7 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -43.21 78.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 111.301 -179.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -67.16 -46.27 74.5 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.498 0.666 . . . . 0.0 110.242 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.59 -38.0 83.4 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.469 0.652 . . . . 0.0 110.758 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.8 m -60.41 -33.82 73.05 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.347 0.594 . . . . 0.0 111.115 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.0 tp -61.28 -25.52 67.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.87 0.367 . . . . 0.0 111.605 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -59.84 -25.87 65.35 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.766 -0.584 . . . . 0.0 110.799 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -64.12 -27.28 68.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.204 0.526 . . . . 0.0 111.15 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -59.68 -52.51 65.2 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.766 0.793 . . . . 0.0 110.215 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 26.1 t80 64.12 24.72 13.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.116 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -143.5 -61.93 0.4 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.67 -0.644 . . . . 0.0 111.338 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.7 tp -67.58 -37.68 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.395 0.617 . . . . 0.0 110.574 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -52.95 -34.24 54.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -67.33 -50.14 61.23 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.218 0.533 . . . . 0.0 111.31 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -43.35 87.0 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.425 0.631 . . . . 0.0 109.823 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.37 -35.91 81.53 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -99.58 8.37 44.5 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -176.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -120.24 -10.89 9.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.514 -0.742 . . . . 0.0 112.088 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 6.8 pt -61.6 -35.73 68.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 121.867 -0.521 . . . . 0.0 110.527 178.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -47.29 68.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.036 -0.415 . . . . 0.0 110.765 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -68.86 -35.96 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.96 -28.12 67.39 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.427 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 18.2 mm -60.79 -46.14 96.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.284 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 62.6 mt -64.67 -38.48 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.2 -37.19 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 95.3 t -54.55 -40.4 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.66 -39.37 85.94 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 177.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.3 m -66.66 -38.36 86.7 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.722 0.772 . . . . 0.0 109.413 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.39 -46.31 89.03 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.72 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . 0.402 HG23 HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -67.99 -40.56 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.439 -179.561 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.47 -24.2 61.37 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -38.2 82.76 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.88 0.848 . . . . 0.0 109.632 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -55.5 -28.17 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.486 0.715 . . . . 0.0 112.243 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.15 -39.42 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -177.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.63 -30.49 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 O-C-N 121.609 -0.682 . . . . 0.0 109.704 176.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -55.95 -29.06 59.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.92 0.39 . . . . 0.0 110.445 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.04 71.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.6 m -59.56 -35.85 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.025 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.73 -39.45 77.33 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 58.1 m -62.72 -38.29 89.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.581 0.705 . . . . 0.0 109.794 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -45.72 93.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.31 1.052 . . . . 0.0 108.571 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.35 -45.27 99.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.12 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 3.2 m120 -62.68 -38.45 90.44 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.244 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -62.61 -45.94 90.57 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.805 -0.559 . . . . 0.0 111.0 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.19 -42.01 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-O 122.233 1.016 . . . . 0.0 109.033 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -70.56 -18.93 62.92 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 27.5 tt0 -86.72 -13.47 45.25 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.499 0.666 . . . . 0.0 111.876 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 97.09 46.61 2.38 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.1 t80 52.18 -127.73 2.41 Favored 'General case' 0 CA--C 1.564 1.5 0 O-C-N 122.0 -0.706 . . . . 0.0 109.8 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 66.2 m -62.25 130.9 93.41 Favored Pre-proline 0 C--N 1.347 0.49 0 O-C-N 120.987 -1.071 . . . . 0.0 109.378 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -43.59 106.62 0.08 OUTLIER 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 121.111 1.207 . . . . 0.0 111.922 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -99.61 -5.4 29.09 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 122.507 1.146 . . . . 0.0 109.18 -178.699 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 121.872 0.844 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -57.74 -26.09 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.634 0.73 . . . . 0.0 110.739 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.8 -22.78 26.34 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 5.8 mtm105 -65.63 -46.62 78.56 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.663 -0.648 . . . . 0.0 112.472 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -44.62 91.52 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.75 -0.594 . . . . 0.0 110.827 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -40.15 72.48 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.125 -0.36 . . . . 0.0 111.331 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 61.9 p -65.5 -33.46 75.98 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 122.203 -0.311 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.17 -46.45 95.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.28 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.519 ' HB3' ' CD2' ' C' ' 785' ' ' LEU . 0.0 OUTLIER -62.09 -8.71 5.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.171 -1.412 . . . . 0.0 111.313 -177.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.73 -14.94 2.55 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.427 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.316 1.9 t -52.97 -54.59 16.06 Favored 'Isoleucine or valine' 0 C--N 1.35 0.595 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 176.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -73.36 -28.58 62.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.06 -1.427 . . . . 0.0 109.103 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.78 -19.9 30.57 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.035 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 78.6 p -57.93 -37.74 74.64 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 36.8 tp -62.1 -50.87 70.2 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.16 72.4 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.629 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.97 -44.05 91.48 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.62 -0.675 . . . . 0.0 110.768 -178.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.8 mt -61.56 -36.97 76.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.62 68.84 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.228 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.551 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 51.5 m-20 -55.58 -43.85 76.36 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.383 0.611 . . . . 0.0 109.805 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.46 -41.08 73.26 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 110.682 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.65 -33.54 76.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.711 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -77.42 -30.84 53.66 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 6.5 p -77.33 -45.25 26.73 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.359 -0.838 . . . . 0.0 110.342 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -53.72 23.3 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -178.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 92.0 p -98.13 -49.15 4.84 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.538 -0.726 . . . . 0.0 112.69 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 17.4 tp 101.29 -87.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.318 1.447 . . . . 0.0 110.689 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -110.8 -70.68 0.8 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.468 -0.77 . . . . 0.0 110.976 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.4 t -87.25 158.74 19.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.201 0.524 . . . . 0.0 110.322 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -83.11 13.26 4.23 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.037 0.446 . . . . 0.0 111.529 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -98.93 -41.73 7.46 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.622 0.725 . . . . 0.0 109.321 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -56.04 -29.91 61.13 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.753 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -31.02 69.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.051 -0.406 . . . . 0.0 111.244 -177.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ptt85 -57.49 -40.18 78.07 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.612 0.72 . . . . 0.0 109.637 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.39 -42.98 74.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.048 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.428 ' O ' HD12 ' A' ' 777' ' ' ILE . 5.3 tt -60.57 -38.42 84.5 Favored 'General case' 0 C--N 1.349 0.56 0 CA-C-O 121.438 0.637 . . . . 0.0 110.459 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -35.76 72.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.146 0.974 . . . . 0.0 109.328 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.95 -44.95 65.01 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.399 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . 0.428 HD12 ' O ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -65.82 -37.3 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.91 -0.494 . . . . 0.0 111.056 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 17.4 m -60.81 -46.54 96.0 Favored 'Isoleucine or valine' 0 C--N 1.35 0.588 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.271 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 7.2 m -64.22 -36.91 85.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-O 121.824 0.821 . . . . 0.0 109.674 177.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -65.58 -30.35 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.944 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . 0.401 HG23 ' N ' ' A' ' 782' ' ' VAL . 3.5 tp -53.49 -36.57 27.92 Favored 'Isoleucine or valine' 0 C--N 1.348 0.529 0 O-C-N 121.887 -0.508 . . . . 0.0 111.28 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.401 ' N ' HG23 ' A' ' 781' ' ' ILE . 16.7 m -55.09 -38.11 45.19 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 C-N-CA 119.354 -0.939 . . . . 0.0 110.271 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -64.91 -46.58 81.11 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.509 0.671 . . . . 0.0 110.756 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.47 -40.9 96.56 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.527 0.679 . . . . 0.0 111.39 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 59.4 tp -87.22 -10.74 51.74 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 121.102 0.477 . . . . 0.0 111.746 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -76.43 -32.47 51.3 Favored Glycine 0 CA--C 1.534 1.239 0 O-C-N 121.853 -0.529 . . . . 0.0 111.943 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 152.15 45.89 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.649 0.737 . . . . 0.0 111.106 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.97 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 60.92 116.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.313 0.577 . . . . 0.0 110.506 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -173.72 161.98 3.98 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.347 0.594 . . . . 0.0 109.64 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -55.41 -43.99 75.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.656 0.741 . . . . 0.0 110.31 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.18 -28.62 67.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.376 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.0 tptt -75.57 -48.9 20.36 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.045 0.45 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -58.55 -45.99 87.77 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.616 0.722 . . . . 0.0 110.39 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.22 66.66 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.681 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 27.6 t -72.32 -26.82 62.09 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.987 0.422 . . . . 0.0 111.545 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.37 -39.16 92.26 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.964 -0.46 . . . . 0.0 111.602 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -59.73 -20.36 56.0 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.931 -0.481 . . . . 0.0 111.355 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -82.07 -24.43 35.26 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.292 0.568 . . . . 0.0 111.006 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -68.9 -47.27 66.22 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.511 0.672 . . . . 0.0 110.626 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 44.2 t80 58.28 32.17 21.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.68 0.752 . . . . 0.0 111.31 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -140.26 -70.83 0.38 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.815 -0.553 . . . . 0.0 110.662 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.15 -37.5 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 121.848 -0.532 . . . . 0.0 111.081 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -52.56 -35.46 53.81 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 24.7 m120 -62.83 -50.08 72.36 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.493 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -66.24 -43.77 85.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.982 0.896 . . . . 0.0 109.638 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.66 -35.72 78.75 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.127 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -94.79 -50.83 4.97 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -53.33 -18.2 2.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 1.9 pp -60.51 -36.65 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.759 -0.588 . . . . 0.0 110.544 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 14.1 ttt-85 -58.25 -47.46 83.49 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.908 -0.495 . . . . 0.0 110.93 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -68.04 -34.48 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -27.94 69.2 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.253 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 18.5 mm -60.7 -50.87 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.417 0.627 . . . . 0.0 110.213 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.68 -40.4 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.27 0.557 . . . . 0.0 109.524 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.52 -38.9 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.85 -48.12 90.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.51 -27.0 10.89 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.769 -0.582 . . . . 0.0 111.744 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 5.4 m -60.81 -45.27 95.09 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.401 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.26 -32.39 69.96 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.651 -0.656 . . . . 0.0 112.546 -176.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.401 ' H ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.88 -46.36 87.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 O-C-N 121.725 -0.609 . . . . 0.0 110.165 -178.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.98 -31.73 79.61 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.66 -36.55 72.04 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.493 1.139 . . . . 0.0 110.389 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -55.59 -28.88 57.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -177.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -36.68 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.907 -1.121 . . . . 0.0 110.251 -176.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.36 -30.85 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.444 -0.785 . . . . 0.0 110.92 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -56.71 -31.42 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.857 -0.527 . . . . 0.0 110.404 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.4 80.37 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.51 -38.06 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.96 -37.68 88.47 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.157 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 59.6 p -64.06 -34.55 78.27 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.212 0.53 . . . . 0.0 110.743 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -43.12 94.73 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.129 0.966 . . . . 0.0 109.161 178.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.98 -44.92 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.15 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.54 -36.15 81.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -62.04 -50.03 73.63 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 122.071 0.939 . . . . 0.0 109.999 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.7 t -77.57 -44.07 29.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.921 -1.036 . . . . 0.0 113.239 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -57.79 -44.24 86.13 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 6.6 pt20 -103.79 -23.76 13.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.58 128.51 3.0 Favored Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -71.19 -60.55 2.17 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.75 152.28 90.59 Favored Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 121.152 -0.967 . . . . 0.0 110.58 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -32.72 113.49 0.06 OUTLIER 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.563 2.176 . . . . 0.0 112.501 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.3 -16.33 59.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 122.097 0.951 . . . . 0.0 112.126 -178.976 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 121.002 0.43 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -28.15 63.16 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.081 0.467 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.16 -7.12 3.66 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . 0.412 ' O ' HG13 ' B' ' 746' ' ' ILE . 8.2 ttp-105 -68.19 -40.25 82.28 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.806 -0.559 . . . . 0.0 111.623 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.11 -43.68 87.31 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.243 0.544 . . . . 0.0 109.715 -179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -39.33 71.45 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.188 178.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.6 p -56.94 -34.41 67.97 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 121.326 -0.858 . . . . 0.0 110.957 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 742' ' ' ARG . 87.1 mt -52.88 -25.2 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.478 -0.773 . . . . 0.0 112.287 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -28.48 67.31 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.783 1.629 . . . . 0.0 109.132 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 3.5 mt -55.9 -16.36 4.56 Favored 'General case' 0 C--N 1.353 0.741 0 O-C-N 121.75 -0.594 . . . . 0.0 110.696 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 31.8 t -56.54 -54.13 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 106.978 -1.489 . . . . 0.0 106.978 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -72.68 -16.37 61.69 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.473 175.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.19 -20.58 36.21 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.716 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 14.4 m -58.72 -37.93 77.2 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.999 0.9 . . . . 0.0 109.882 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.78 -51.05 37.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.483 0.658 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.92 76.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.232 0.539 . . . . 0.0 111.67 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.5 tt -59.12 -45.36 91.13 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.907 -0.496 . . . . 0.0 110.734 -177.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.4 mt -66.08 -36.27 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 122.135 0.969 . . . . 0.0 108.844 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.12 -29.53 69.3 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.834 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -54.94 -48.21 73.45 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.586 -0.697 . . . . 0.0 109.466 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.92 -45.48 64.19 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.14 -46.43 74.09 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -64.9 -29.74 70.7 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.819 -0.55 . . . . 0.0 112.372 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 80.0 p -75.71 -45.47 36.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.543 0.687 . . . . 0.0 110.95 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 2.0 mp -61.07 -54.77 40.64 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 13.7 p -98.71 -49.62 4.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.528 0.68 . . . . 0.0 112.678 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 12.8 tp 71.1 99.66 0.06 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.718 0.77 . . . . 0.0 110.47 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.89 -80.94 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.207 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 17.6 p -84.31 158.32 21.22 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.638 -0.664 . . . . 0.0 110.558 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -89.52 -31.76 17.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.96 0.409 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.26 -37.71 64.99 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.999 0.904 . . . . 0.0 109.199 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -56.22 -29.77 61.41 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.546 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.65 -41.0 89.54 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.905 -0.497 . . . . 0.0 109.698 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -57.74 -42.91 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.94 -46.17 90.5 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -37.77 78.41 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.741 0.782 . . . . 0.0 109.997 178.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.07 -36.91 73.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.074 -178.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 49.5 mt -70.71 -48.34 55.09 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.585 -0.697 . . . . 0.0 111.364 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 18.4 pt -62.58 -36.12 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.899 0.38 . . . . 0.0 109.98 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -54.81 -45.79 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -36.03 82.56 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.641 0.734 . . . . 0.0 110.492 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -67.08 -37.88 84.75 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 64.1 mt -63.92 -41.59 93.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.999 -0.438 . . . . 0.0 111.266 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.8 m -58.14 -38.58 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 121.282 -0.886 . . . . 0.0 110.176 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -59.97 -42.08 93.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.725 0.774 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.59 -43.36 85.1 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.605 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 5.9 tp -82.36 -18.31 42.56 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 122.05 -0.406 . . . . 0.0 111.604 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -50.76 -42.94 46.76 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 118.89 36.62 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.759 -179.414 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 8.3 mp 59.02 109.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.712 0.768 . . . . 0.0 110.807 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -173.11 165.74 4.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.488 0.661 . . . . 0.0 110.243 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.7 -55.74 15.14 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.486 0.66 . . . . 0.0 110.591 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -71.03 -19.66 62.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.538 . . . . 0.0 112.384 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -80.61 -44.71 18.48 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.074 -0.391 . . . . 0.0 111.187 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -64.64 -45.76 85.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.407 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.24 -19.3 65.78 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.936 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 15.7 p -72.17 -28.63 63.35 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.815 -0.553 . . . . 0.0 111.327 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.33 -38.66 87.7 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 122.106 -0.372 . . . . 0.0 111.621 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -59.58 -29.79 68.2 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.599 -0.688 . . . . 0.0 110.985 -178.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -63.94 -31.99 73.36 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.472 0.653 . . . . 0.0 110.624 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -63.31 -41.65 98.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.495 0.664 . . . . 0.0 110.371 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 52.18 36.75 20.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.542 0.687 . . . . 0.0 111.334 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -146.59 -72.0 0.23 Allowed 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.604 -0.685 . . . . 0.0 111.338 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -67.78 -37.5 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.952 -0.468 . . . . 0.0 110.981 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -52.24 -34.69 47.16 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -66.06 -50.15 65.17 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.712 -0.618 . . . . 0.0 110.451 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.81 -43.85 87.4 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 121.617 0.722 . . . . 0.0 109.727 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.05 -35.89 82.22 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -178.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.98 -8.0 22.81 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -97.81 -11.66 23.06 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.378 -0.826 . . . . 0.0 112.927 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.3 pp -60.91 -36.6 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 O-C-N 121.744 -0.597 . . . . 0.0 110.499 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 ttt-85 -54.09 -47.42 71.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.776 0.322 . . . . 0.0 111.1 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -68.81 -35.95 71.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.79 -32.37 70.55 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.92 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 7.8 mm -60.61 -44.34 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.35 -41.62 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.88 -37.69 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 94.0 t -54.95 -39.8 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.22 -42.52 82.44 Favored Glycine 0 C--N 1.346 1.137 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.4 -38.7 90.74 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.991 0.9 . . . . 0.0 109.021 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 tp -59.87 -43.99 94.42 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.083 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.2 pp -65.63 -41.86 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.979 -0.45 . . . . 0.0 109.91 -178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.25 -27.74 71.99 Favored Glycine 0 CA--C 1.537 1.429 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 178.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.6 tt -60.86 -39.46 89.25 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.877 0.846 . . . . 0.0 110.113 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.25 -29.17 60.72 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . 0.431 HG21 HD12 ' C' ' 697' ' ' ILE . 0.1 OUTLIER -59.26 -36.21 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -176.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.38 -30.6 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.317 -0.864 . . . . 0.0 110.631 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -56.45 -31.32 63.86 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.999 -0.438 . . . . 0.0 110.281 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.72 79.0 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 177.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -43.44 92.8 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 122.07 0.938 . . . . 0.0 108.565 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.9 -37.67 87.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.403 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.3 m -62.76 -39.17 93.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.196 0.522 . . . . 0.0 110.343 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.12 -44.98 95.46 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.62 -45.16 99.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.85 0.833 . . . . 0.0 108.892 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -62.6 -37.0 84.54 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.373 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.31 -49.78 71.29 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -36.02 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.36 0.6 . . . . 0.0 111.95 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -70.36 -44.25 68.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.04 -21.49 13.92 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.01 178.54 17.8 Favored Glycine 0 CA--C 1.537 1.448 0 N-CA-C 110.194 -1.162 . . . . 0.0 110.194 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -132.9 -54.42 0.93 Allowed 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.896 -0.767 . . . . 0.0 112.328 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 1.7 m -71.66 142.0 85.62 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-O 118.776 -0.63 . . . . 0.0 109.309 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -30.06 96.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 123.101 2.534 . . . . 0.0 113.195 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.48 18.5 2.25 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.492 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.838 0.827 . . . . 0.0 109.647 -179.115 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.997 0.904 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -69.19 -26.47 64.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.143 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -64.71 -36.99 86.08 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -74.34 -38.57 63.22 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.27 -37.47 75.05 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.941 -1.099 . . . . 0.0 109.337 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -71.43 -37.04 71.48 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.885 0.374 . . . . 0.0 110.475 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 18.9 p -67.94 -35.28 78.15 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.831 -0.543 . . . . 0.0 111.243 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.5 -22.2 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -59.47 -30.05 68.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -16.35 48.58 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.539 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 44.5 t -55.53 -54.47 25.2 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -72.53 -24.64 61.17 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 122.223 1.011 . . . . 0.0 108.547 174.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -20.13 32.54 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.996 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 42.7 m -58.44 -40.71 83.32 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 117.546 0.673 . . . . 0.0 109.332 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 22.6 tp -62.85 -51.14 68.16 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.91 -34.4 71.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.713 0.768 . . . . 0.0 111.28 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.56 -45.25 89.35 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.489 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.73 -29.54 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.68 -31.64 69.8 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -55.43 -47.17 76.38 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.937 -1.102 . . . . 0.0 109.622 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.59 -45.27 65.67 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.32 -45.98 78.47 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -66.61 -49.64 65.66 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 23.0 p -67.51 -40.89 85.14 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.68 -0.637 . . . . 0.0 111.042 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -54.47 15.97 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.75 -49.37 4.85 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.304 -0.873 . . . . 0.0 112.331 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 6.5 tp 78.17 83.62 0.07 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 122.088 0.947 . . . . 0.0 111.042 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.17 -81.01 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.389 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 16.8 p -86.5 165.97 15.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.529 -0.732 . . . . 0.0 111.683 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -28.52 29.46 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -52.88 -37.16 60.14 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.964 0.888 . . . . 0.0 108.932 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 71.4 mmt-85 -69.31 -30.9 69.06 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.628 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 8.6 tt -60.97 -35.35 76.56 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.738 -0.601 . . . . 0.0 109.961 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -57.34 -35.18 69.58 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -63.06 -42.08 99.6 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . 0.401 ' O ' HD13 ' C' ' 774' ' ' LEU . 0.2 OUTLIER -63.25 -38.52 91.47 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-O 122.057 0.932 . . . . 0.0 109.104 177.868 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.11 -43.18 87.02 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.737 -0.602 . . . . 0.0 110.036 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.13 -35.58 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.337 0.589 . . . . 0.0 110.737 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 2.7 tt -65.17 -37.59 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.158 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.39 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.323 -0.861 . . . . 0.0 110.642 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.6 m -64.42 -48.72 74.28 Favored 'General case' 0 C--N 1.344 0.331 0 O-C-N 121.833 -0.542 . . . . 0.0 112.085 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -31.56 71.74 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.389 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 19.6 mt -54.96 -36.15 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 122.215 -0.303 . . . . 0.0 110.649 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.481 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 23.0 m -52.87 -38.09 27.48 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 O-C-N 121.256 -0.902 . . . . 0.0 110.944 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -54.88 -41.31 70.71 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.333 0.587 . . . . 0.0 111.188 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 24.1 tp -68.83 -44.82 72.64 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.519 ' CD2' ' HB3' ' A' ' 747' ' ' ARG . 5.6 tp -74.99 -27.9 60.34 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 119.586 1.084 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -41.63 -49.08 4.94 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -97.15 115.42 27.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.841 0.829 . . . . 0.0 109.654 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 10.3 tpt85 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.794 -178.953 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.689 0.757 . . . . 0.0 109.128 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 33.4 mt 59.52 106.75 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.978 0.894 . . . . 0.0 110.797 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 179.41 -178.62 0.37 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.18 -46.04 86.46 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 121.363 -0.836 . . . . 0.0 109.696 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.9 -33.02 73.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.463 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 -49.05 11.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 111.007 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -64.8 -40.72 95.7 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 110.685 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.12 62.58 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.703 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -29.98 64.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.17 0.51 . . . . 0.0 111.001 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.78 -36.78 77.38 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.057 -0.402 . . . . 0.0 110.898 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -59.71 -17.4 34.33 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.884 0.373 . . . . 0.0 111.384 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.68 -29.02 21.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.334 0.588 . . . . 0.0 110.661 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -59.9 -48.97 79.51 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.681 0.753 . . . . 0.0 110.576 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 60.25 40.03 18.39 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.892 0.853 . . . . 0.0 110.58 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -71.06 0.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.923 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.9 tp -68.25 -37.51 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 121.957 -0.464 . . . . 0.0 111.326 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.15 -35.73 49.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -64.71 -50.14 68.14 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.376 0.608 . . . . 0.0 110.568 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -65.53 -43.05 91.21 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.675 0.75 . . . . 0.0 109.997 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -35.62 81.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -102.82 -3.15 26.76 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -109.37 -5.61 15.77 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.346 0.975 . . . . 0.0 112.729 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.7 pt -68.48 -36.13 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 110.779 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -53.26 -41.73 65.79 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.254 0.549 . . . . 0.0 110.047 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -76.8 -34.96 23.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 177.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.84 -38.93 83.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.169 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.6 -45.58 97.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 86.3 mt -61.73 -39.55 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.85 -37.73 73.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.982 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.85 -40.04 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.49 83.48 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 16.4 m -62.14 -38.68 89.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.04 0.924 . . . . 0.0 109.606 177.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.29 -39.33 86.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.923 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.7 -43.17 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-O 121.153 0.501 . . . . 0.0 110.39 -178.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.12 92.96 Favored Glycine 0 CA--C 1.535 1.321 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.1 tt -53.5 -38.7 63.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 122.278 1.037 . . . . 0.0 110.045 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -57.02 -28.82 62.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.091 0.956 . . . . 0.0 112.362 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 40.7 mt -59.51 -36.54 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 O-C-N 121.502 -0.749 . . . . 0.0 110.438 -176.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 2.5 p -66.49 -30.51 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.468 -0.77 . . . . 0.0 110.763 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -55.59 -28.53 55.61 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.547 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.4 -36.9 71.89 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.8 m -61.17 -36.6 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.533 -0.729 . . . . 0.0 109.578 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.9 tp -57.62 -37.64 73.61 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.995 -0.44 . . . . 0.0 110.429 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 16.0 m -62.24 -40.49 96.35 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.442 0.639 . . . . 0.0 109.997 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.59 -43.17 97.68 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.4 t -64.71 -45.01 96.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 CA-C-O 121.858 0.837 . . . . 0.0 109.101 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.84 -36.2 80.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.876 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -65.71 -49.52 68.2 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.22 0.534 . . . . 0.0 111.668 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -76.32 -44.06 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.921 0.867 . . . . 0.0 110.279 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -63.37 -22.09 66.67 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -92.85 -21.77 19.68 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.181 -0.949 . . . . 0.0 112.114 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 111.79 35.42 1.86 Allowed Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 71.97 -171.93 0.15 Allowed 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.28 1.038 . . . . 0.0 111.502 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 3.7 m -62.46 161.25 27.65 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.499 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -12.51 92.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 124.56 3.507 . . . . 0.0 115.692 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.83 -17.16 14.28 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.919 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 122.292 1.044 . . . . 0.0 110.932 -178.546 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-O 121.922 0.868 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -26.1 65.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.296 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -55.79 -6.79 0.24 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.22 -41.54 88.87 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.273 -0.892 . . . . 0.0 109.757 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.04 -45.19 78.2 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.143 0.497 . . . . 0.0 110.442 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -30.86 71.32 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.275 0.559 . . . . 0.0 110.651 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 13.1 p -67.53 -46.56 72.47 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.404 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.5 mt -61.46 -47.0 95.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.803 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.616 ' NE ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.91 -7.55 11.9 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 117.844 -1.543 . . . . 0.0 111.278 -177.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -14.82 19.61 Favored 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 171.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.291 1.6 t -53.06 -55.15 13.57 Favored 'Isoleucine or valine' 0 C--N 1.356 0.884 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 177.294 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.446 ' ND2' ' NE ' ' A' ' 747' ' ' ARG . 2.3 m-80 -73.32 -27.64 61.64 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.924 174.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.81 -19.59 29.56 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 89.0 p -57.49 -37.28 72.69 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.86 -48.09 82.11 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.66 -34.88 71.73 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.011 0.434 . . . . 0.0 110.54 177.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.85 -45.07 90.95 Favored 'General case' 0 C--N 1.345 0.397 0 O-C-N 121.981 -0.449 . . . . 0.0 111.412 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.54 -33.08 55.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.16 -30.14 68.31 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.374 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.422 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.0 m-20 -55.16 -45.75 75.7 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.43 -0.794 . . . . 0.0 109.846 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.94 -44.35 69.75 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.473 0.654 . . . . 0.0 111.237 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -37.48 87.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -67.51 -44.56 78.15 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.245 0.545 . . . . 0.0 111.796 -178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.6 t -64.88 -45.18 87.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.962 0.887 . . . . 0.0 111.499 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -54.15 36.58 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -177.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 1.4 m -98.45 -22.99 15.74 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 8.9 tp 77.07 -60.53 0.46 Allowed 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.733 -0.604 . . . . 0.0 109.886 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.96 -67.72 0.29 Allowed 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.019 -0.425 . . . . 0.0 111.108 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.0 m -93.27 155.07 17.65 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.036 0.446 . . . . 0.0 110.531 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.97 -40.27 94.74 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.029 0.442 . . . . 0.0 110.323 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -53.94 -39.22 65.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.885 0.85 . . . . 0.0 109.664 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -58.47 -29.87 66.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.777 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.56 -36.1 75.54 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 109.964 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -57.14 -33.34 67.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.484 0.659 . . . . 0.0 109.524 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -62.83 -42.36 99.7 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.817 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.83 -38.36 78.5 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 121.181 0.515 . . . . 0.0 110.869 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.95 -39.83 93.44 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.158 0.504 . . . . 0.0 111.895 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 39.6 mt -75.11 -42.16 57.02 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.81 -0.556 . . . . 0.0 112.395 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 1.1 pt -68.78 -37.51 77.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.731 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 27.5 m -58.48 -42.65 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.543 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 9.9 t -63.57 -35.38 80.31 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 121.59 -0.694 . . . . 0.0 111.292 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.91 73.14 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.017 0.437 . . . . 0.0 111.692 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.23 -41.97 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.996 -0.44 . . . . 0.0 111.439 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 10.4 m -54.95 -38.82 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.741 -0.6 . . . . 0.0 110.702 -178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -59.87 -48.84 80.07 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.327 0.584 . . . . 0.0 111.086 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.18 -43.37 70.92 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.4 -30.21 64.44 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 121.906 -0.496 . . . . 0.0 111.161 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.09 -30.39 23.5 Favored Glycine 0 CA--C 1.534 1.232 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 9.6 ptt180 -120.97 141.94 50.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.629 0.728 . . . . 0.0 110.975 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 . . . . . 0 C--O 1.22 -0.451 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.554 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 52.29 83.47 0.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.875 0.845 . . . . 0.0 110.539 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -150.79 157.81 43.39 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.685 0.755 . . . . 0.0 110.555 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.0 -57.69 4.75 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 122.283 1.039 . . . . 0.0 111.559 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -64.33 -28.92 70.04 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.437 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -71.62 -49.43 40.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.03 0.443 . . . . 0.0 110.401 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -61.95 -46.63 88.44 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.355 0.597 . . . . 0.0 110.518 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.36 -21.49 66.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.7 t -70.67 -32.9 70.34 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 111.038 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.46 -31.53 70.52 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.402 0.62 . . . . 0.0 111.087 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -59.61 -21.11 59.93 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.185 0.516 . . . . 0.0 111.321 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -86.8 -26.8 23.92 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.16 0.505 . . . . 0.0 111.216 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -60.13 -48.44 81.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.419 0.628 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.2 t80 59.82 40.86 18.91 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 122.027 0.917 . . . . 0.0 110.817 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.61 -72.05 0.2 Allowed 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.856 -0.528 . . . . 0.0 110.687 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -68.42 -37.22 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 O-C-N 121.961 -0.462 . . . . 0.0 111.303 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -52.36 -33.96 45.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -69.02 -50.14 51.43 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.604 -0.685 . . . . 0.0 110.875 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -65.76 -44.26 86.4 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.824 0.821 . . . . 0.0 109.126 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.17 -35.89 81.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -95.9 -21.0 18.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -95.95 -5.27 41.72 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.285 -0.885 . . . . 0.0 112.17 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.473 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 4.3 pt -62.59 -36.65 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.721 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -53.04 -47.36 68.47 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.979 0.419 . . . . 0.0 110.62 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.57 -35.33 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.473 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.34 -31.12 70.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.957 179.475 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 19.2 mm -60.8 -44.72 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 109.856 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.34 -41.07 88.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.305 0.574 . . . . 0.0 109.502 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.11 -38.79 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 54.0 t -57.63 -39.71 71.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -64.64 -26.77 71.18 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.4 m -60.62 -46.6 89.66 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.403 HD13 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.91 -33.34 71.74 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -176.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.403 ' H ' HD13 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.84 -41.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 -178.697 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.67 -34.3 88.08 Favored Glycine 0 CA--C 1.537 1.413 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.72 -37.04 77.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.224 1.012 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -55.93 -28.54 57.3 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 20.4 tt -58.63 -36.08 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 O-C-N 121.169 -0.957 . . . . 0.0 110.696 -176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -54.52 -30.26 21.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 O-C-N 121.859 -0.526 . . . . 0.0 110.899 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -55.98 -30.0 61.1 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.729 -0.607 . . . . 0.0 110.389 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.42 -40.81 83.49 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.35 -35.99 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tp -51.65 -37.76 51.81 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.815 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 43.0 m -62.82 -38.82 92.25 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.751 0.786 . . . . 0.0 109.948 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -43.15 99.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.429 1.109 . . . . 0.0 108.801 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 57.6 t -67.67 -40.64 84.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.695 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -62.4 -37.61 86.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.028 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -68.13 -44.31 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.152 0.977 . . . . 0.0 111.273 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.55 -45.35 33.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -65.88 -45.84 80.57 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 118.877 -1.129 . . . . 0.0 112.96 -175.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.422 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 0.9 OUTLIER -105.57 -24.16 12.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 -179.372 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.95 164.03 10.94 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -102.49 -61.58 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.5 p -65.55 158.81 72.01 Favored Pre-proline 0 N--CA 1.468 0.427 0 O-C-N 121.316 -0.865 . . . . 0.0 109.637 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -29.32 118.59 0.05 OUTLIER 'Trans proline' 0 N--CA 1.496 1.676 0 C-N-CA 122.784 2.323 . . . . 0.0 112.981 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 5.0 tt -83.65 -19.01 36.14 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 122.535 1.159 . . . . 0.0 111.282 -178.844 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 122.082 0.944 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 42.1 mtp85 -72.59 -25.87 61.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.254 -0.884 . . . . 0.0 113.201 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.13 -9.38 0.39 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -176.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 1.4 mtm105 -60.45 -37.62 81.54 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.406 -0.809 . . . . 0.0 110.175 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.22 -29.85 66.03 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.043 0.449 . . . . 0.0 109.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -49.39 43.44 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 121.532 0.682 . . . . 0.0 109.647 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -59.85 -33.92 72.44 Favored 'General case' 0 N--CA 1.46 0.068 0 O-C-N 122.026 -0.422 . . . . 0.0 110.214 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.07 -22.02 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 31.8 ttt-85 -59.58 -17.32 31.89 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 7.2 tt -55.03 -27.04 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 94.7 t -55.05 -53.82 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -72.66 -24.32 61.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.331 -1.304 . . . . 0.0 109.837 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.54 37.81 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.242 -178.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 24.7 m -59.43 -38.7 81.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 117.857 0.828 . . . . 0.0 109.656 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 26.0 tp -69.54 -47.13 64.71 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.49 0.662 . . . . 0.0 110.179 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.59 -35.44 77.37 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.51 -45.34 92.0 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.06 -0.4 . . . . 0.0 111.665 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.76 -36.81 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 121.377 0.608 . . . . 0.0 110.011 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.97 -30.59 69.05 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -55.91 -49.75 72.59 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.04 -1.038 . . . . 0.0 109.934 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -70.8 -42.56 70.14 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.31 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.6 -45.98 70.54 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -177.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -65.36 -20.48 66.41 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.6 m -76.6 -45.64 29.37 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.768 -0.582 . . . . 0.0 111.326 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -54.87 14.42 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 5.3 t -98.97 -49.83 4.39 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.855 0.836 . . . . 0.0 112.294 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.3 tt 63.86 89.34 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.825 0.822 . . . . 0.0 109.384 -177.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 13.1 t80 72.74 122.11 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.514 0.673 . . . . 0.0 111.222 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.0 m 57.82 164.26 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.316 0.579 . . . . 0.0 111.451 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -109.84 64.31 0.61 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.781 1.277 . . . . 0.0 110.395 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.25 -42.51 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 122.474 1.13 . . . . 0.0 108.115 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -55.94 -29.03 59.5 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.527 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -59.38 -31.09 68.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.247 -177.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -43.02 99.59 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -68.99 -45.2 71.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.634 . . . . 0.0 109.807 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . 0.466 ' O ' HG13 ' B' ' 777' ' ' ILE . 0.1 OUTLIER -60.34 -37.87 81.98 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.752 0.787 . . . . 0.0 109.998 178.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -58.03 -36.8 73.24 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.673 -0.642 . . . . 0.0 110.007 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.4 mt -71.78 -38.22 70.33 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.103 -0.373 . . . . 0.0 111.884 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . 0.466 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.4 pp -69.4 -37.45 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.52 -0.738 . . . . 0.0 109.877 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 83.5 t -60.53 -46.6 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.42 -0.8 . . . . 0.0 110.012 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.6 t -63.85 -41.11 97.88 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.852 -0.53 . . . . 0.0 112.413 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.63 72.08 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.716 -0.615 . . . . 0.0 111.91 -178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.8 mt -57.88 -37.03 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 O-C-N 121.78 -0.575 . . . . 0.0 111.049 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 16.1 m -54.49 -38.14 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.301 -0.875 . . . . 0.0 110.012 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -64.33 -44.61 90.99 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.342 0.592 . . . . 0.0 110.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.08 -42.12 80.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.467 0.651 . . . . 0.0 111.253 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 8.2 tp -76.98 -20.29 56.27 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.245 0.545 . . . . 0.0 111.275 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -55.84 -28.21 52.12 Favored Glycine 0 CA--C 1.534 1.229 0 O-C-N 122.005 -0.435 . . . . 0.0 112.107 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.17 128.24 54.53 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.809 -0.818 . . . . 0.0 110.633 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.454 179.524 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.792 0.806 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.6 142.9 11.24 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -173.2 176.0 3.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.443 0.639 . . . . 0.0 110.975 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -52.94 -46.54 68.18 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 122.036 0.922 . . . . 0.0 110.943 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -64.53 -26.62 68.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.58 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -81.14 -42.38 20.99 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 110.412 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -60.71 -44.79 96.16 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.583 0.706 . . . . 0.0 110.613 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.71 -26.65 64.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.208 0.528 . . . . 0.0 111.646 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.4 t -61.33 -30.32 70.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.98 -0.45 . . . . 0.0 112.07 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.7 -39.51 88.11 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -59.8 -27.65 66.77 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.649 -0.657 . . . . 0.0 111.091 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -66.3 -32.86 74.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.292 0.567 . . . . 0.0 110.129 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -63.87 -40.93 97.7 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.792 0.806 . . . . 0.0 109.637 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.1 t80 62.16 12.24 4.93 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.978 0.732 . . . . 0.0 112.978 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -136.72 -59.94 0.71 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.566 -0.709 . . . . 0.0 112.592 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -38.23 81.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.504 0.668 . . . . 0.0 110.731 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.8 m -52.84 -38.57 61.61 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.173 0.511 . . . . 0.0 110.967 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -59.34 -49.05 79.3 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.622 0.725 . . . . 0.0 109.933 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -60.19 -43.4 95.92 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.167 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.21 -40.05 90.05 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -94.87 -10.04 32.5 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -94.6 -22.9 17.88 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.714 -0.616 . . . . 0.0 111.933 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.432 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 13.4 pt -64.51 -36.9 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.93 -0.481 . . . . 0.0 110.738 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 7.5 ttt-85 -54.47 -47.22 73.22 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.67 -34.48 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 177.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . 0.432 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.7 OUTLIER -60.34 -37.27 80.12 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.737 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 10.9 mm -61.08 -47.19 94.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.103 0.478 . . . . 0.0 109.749 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.04 -37.06 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.93 -38.87 75.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 65.4 t -58.55 -40.12 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.74 -36.29 65.17 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 12.1 m -67.31 -38.94 85.77 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.47 1.128 . . . . 0.0 110.222 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -46.49 89.16 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.425 -1.261 . . . . 0.0 114.053 -176.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -59.91 -41.58 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 O-C-N 121.82 -0.55 . . . . 0.0 110.761 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -37.06 92.33 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.97 -37.35 66.39 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.545 0.688 . . . . 0.0 109.955 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -56.71 -30.54 63.6 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.999 -0.438 . . . . 0.0 111.695 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 13.4 tt -60.98 -36.89 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.8 t -67.13 -30.7 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.635 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -62.05 -30.99 71.36 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.108 0.48 . . . . 0.0 110.115 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.75 76.43 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -63.0 -39.71 86.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -37.98 87.46 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.677 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.0 m -62.82 -37.84 88.33 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.819 -0.551 . . . . 0.0 110.285 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.96 -41.71 98.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.813 0.816 . . . . 0.0 108.807 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.72 -44.67 99.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.266 1.031 . . . . 0.0 108.475 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -60.16 -35.6 75.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.117 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -47.95 83.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.707 0.765 . . . . 0.0 110.826 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -41.28 41.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.768 0.794 . . . . 0.0 110.769 -178.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -73.19 -33.6 65.51 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.684 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -102.29 -15.77 16.49 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 103.7 -173.06 21.54 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -132.22 -53.44 0.97 Allowed 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.544 -0.974 . . . . 0.0 112.749 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 8.4 m -93.94 146.5 31.78 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-O 118.28 -0.867 . . . . 0.0 109.641 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -31.31 93.56 0.01 OUTLIER 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.623 2.215 . . . . 0.0 112.811 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . 0.439 ' O ' ' C ' ' C' ' 716' ' ' SER . 17.2 tp -73.68 -10.42 59.67 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 716' ' ' SER . . . . . 0.439 ' C ' ' O ' ' C' ' 715' ' ' LEU . 14.2 t . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 121.19 0.519 . . . . 0.0 112.29 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -26.43 62.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.51 -47.85 82.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.3 ttp85 -63.88 -36.83 85.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -58.73 -34.14 71.01 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.029 1.286 . . . . 0.0 109.268 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -71.22 -32.73 69.14 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.489 0.662 . . . . 0.0 109.655 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 5.0 p -66.5 -47.31 73.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.92 0.39 . . . . 0.0 110.078 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.0 mp -53.98 -41.07 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 O-C-N 121.404 -0.81 . . . . 0.0 110.737 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -60.99 -16.13 39.61 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 118.372 -1.331 . . . . 0.0 110.417 -178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.27 -19.26 64.41 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.362 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.0 t -55.21 -54.03 28.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.725 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -72.53 -27.12 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.816 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.67 37.46 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.53 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 97.8 p -58.69 -38.82 79.07 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.038 -0.684 . . . . 0.0 109.356 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 20.8 tp -67.07 -49.02 66.46 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.45 -35.42 74.02 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.644 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.65 -45.34 92.31 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.837 -0.539 . . . . 0.0 110.706 -178.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.35 -41.39 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.478 0.656 . . . . 0.0 109.266 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -68.4 -30.86 69.87 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.11 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -55.65 -49.48 72.77 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.347 -0.846 . . . . 0.0 110.009 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -71.12 -45.02 64.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.493 0.663 . . . . 0.0 111.049 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.44 -44.15 96.09 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -74.46 -47.5 33.11 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -177.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 79.3 p -67.34 -43.75 80.75 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.85 0.833 . . . . 0.0 111.196 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.73 -53.22 60.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.636 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 34.3 m -96.79 -13.43 22.62 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 9.0 mt 57.27 67.69 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.954 0.883 . . . . 0.0 110.717 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 59.3 t80 79.07 -89.62 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 61.8 m -93.78 171.79 8.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.305 -0.872 . . . . 0.0 111.986 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.28 -33.61 67.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.224 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -54.4 -35.08 62.49 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.019 0.914 . . . . 0.0 108.812 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.25 -30.17 64.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.798 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -60.06 -35.13 74.47 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -33.9 67.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -41.36 98.85 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 6.7 tp -59.35 -38.98 81.76 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-O 121.142 0.496 . . . . 0.0 109.717 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.91 -42.55 89.92 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.365 0.602 . . . . 0.0 110.729 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 35.8 mt -74.52 -37.21 63.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 109.668 178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . 0.585 ' O ' HG13 ' C' ' 781' ' ' ILE . 71.4 mt -61.39 -49.06 86.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.123 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 7.5 p -54.76 -39.18 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 8.3 m -63.61 -43.16 97.69 Favored 'General case' 0 C--N 1.335 -0.052 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.679 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -31.86 72.02 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.585 HG13 ' O ' ' C' ' 777' ' ' ILE . 11.5 mt -56.48 -36.27 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.838 -0.539 . . . . 0.0 110.968 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.616 ' HA ' ' NE ' ' A' ' 747' ' ' ARG . 18.0 m -52.47 -37.86 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 121.432 -0.792 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.79 -41.59 87.05 Favored 'General case' 0 CA--C 1.553 1.07 0 O-C-N 121.452 -0.78 . . . . 0.0 111.465 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.6 -44.51 81.93 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . . . . . . . . . 6.5 tp -71.28 -37.35 71.87 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.115 -0.99 . . . . 0.0 109.525 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.08 -33.34 37.12 Favored Glycine 0 CA--C 1.532 1.129 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.82 127.81 34.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.22 -0.447 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.327 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 120.312 0.101 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.7 mt 170.25 119.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.505 -0.747 . . . . 0.0 109.576 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.06 -174.16 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.73 -0.606 . . . . 0.0 109.881 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.34 -40.07 67.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.562 0.696 . . . . 0.0 109.855 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.8 -34.74 74.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.779 -179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -73.53 -44.58 57.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.44 0.638 . . . . 0.0 110.657 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -72.8 -46.26 54.17 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.185 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.97 -30.58 70.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.084 0.469 . . . . 0.0 111.658 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.0 m -65.22 -32.34 73.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.255 0.55 . . . . 0.0 111.005 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.7 -30.57 71.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.861 0.362 . . . . 0.0 111.565 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -59.45 -24.46 63.55 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.708 -0.62 . . . . 0.0 111.195 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -73.3 -22.34 60.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.085 0.469 . . . . 0.0 111.265 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.9 m95 -64.48 -45.28 88.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-O 121.154 0.502 . . . . 0.0 111.171 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . 0.427 ' O ' ' CG ' ' A' ' 673' ' ' PHE . 49.3 t80 60.67 10.03 2.43 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.394 0.616 . . . . 0.0 111.027 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -123.9 -66.94 0.96 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.988 -1.07 . . . . 0.0 111.269 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.98 -37.67 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 122.059 -0.401 . . . . 0.0 111.392 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.5 m -52.7 -38.6 60.93 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -61.79 -50.07 73.83 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 121.271 0.558 . . . . 0.0 110.433 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -65.52 -39.35 91.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.78 0.8 . . . . 0.0 109.654 178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -35.93 81.83 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -104.98 -20.01 13.66 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -84.75 -14.46 48.19 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.282 -0.886 . . . . 0.0 111.84 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . 0.44 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 7.0 pt -60.82 -35.8 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.243 0.544 . . . . 0.0 110.513 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 -53.06 -47.02 68.77 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.151 -0.343 . . . . 0.0 110.346 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.96 -32.01 56.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -62.79 -29.86 71.03 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.158 179.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 21.2 mm -60.72 -45.4 97.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.16 0.505 . . . . 0.0 110.188 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.8 mt -71.12 -37.65 67.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.138 0.494 . . . . 0.0 109.776 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.02 -37.66 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 122.053 -0.404 . . . . 0.0 110.174 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 67.4 t -54.61 -39.91 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.87 -38.77 93.0 Favored Glycine 0 CA--C 1.533 1.178 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.0 m -64.46 -38.3 90.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.815 0.817 . . . . 0.0 109.63 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -45.5 91.48 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.772 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.38 -40.96 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.721 -179.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.78 -21.62 58.64 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 177.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.53 -37.61 86.77 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.813 0.816 . . . . 0.0 109.788 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 3.0 mmt180 -55.02 -28.4 51.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -178.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.4 tt -59.2 -36.79 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 O-C-N 120.559 -1.338 . . . . 0.0 109.427 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.38 -30.92 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-O 121.514 0.673 . . . . 0.0 110.038 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.2 m-85 -55.61 -28.53 55.72 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.334 0.588 . . . . 0.0 109.733 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.0 -36.91 70.95 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.6 m -62.19 -35.72 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 O-C-N 121.59 -0.694 . . . . 0.0 109.485 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.6 -39.21 87.31 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.029 -0.419 . . . . 0.0 110.205 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -62.62 -33.82 75.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.512 0.672 . . . . 0.0 109.854 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -43.13 99.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.402 1.096 . . . . 0.0 108.745 177.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.448 ' HA ' HD21 ' A' ' 748' ' ' LEU . 67.1 t -67.77 -45.21 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.201 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.42 -37.08 84.43 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.512 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -60.19 -49.46 77.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.894 0.854 . . . . 0.0 111.005 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . 0.409 HG23 ' HA ' ' B' ' 713' ' ' SER . 0.9 OUTLIER -74.43 -43.05 49.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.001 0.905 . . . . 0.0 109.423 179.757 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.1 -14.59 61.88 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -98.41 7.68 45.87 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.011 -1.056 . . . . 0.0 113.427 -178.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 81.38 12.33 82.17 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.886 -0.509 . . . . 0.0 112.374 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER 61.94 -123.24 0.76 Allowed 'General case' 0 CA--C 1.564 1.492 0 O-C-N 121.648 -0.913 . . . . 0.0 110.774 179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 13.4 p -62.22 159.1 41.78 Favored Pre-proline 0 C--N 1.355 0.832 0 O-C-N 120.732 -1.23 . . . . 0.0 110.625 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.59 109.04 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.68 1.587 . . . . 0.0 112.836 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.22 -19.1 13.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 14.4 p . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 122.565 1.174 . . . . 0.0 110.427 -179.177 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.838 0.828 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -25.62 62.65 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.71 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.54 -13.28 0.91 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 69.3 mtm-85 -69.19 -46.68 66.86 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.458 -0.777 . . . . 0.0 109.255 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.77 -41.46 86.67 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.746 0.784 . . . . 0.0 110.267 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . 0.513 ' HA ' HD23 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -69.31 -35.47 76.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.444 -0.785 . . . . 0.0 111.192 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.33 -38.39 81.49 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.07 -0.394 . . . . 0.0 111.793 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.554 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.5 mp -64.2 -47.1 91.38 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.258 0 CA-C-O 116.566 -1.683 . . . . 0.0 113.923 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.451 ' CB ' ' CD2' ' C' ' 785' ' ' LEU . 0.2 OUTLIER -64.78 -11.22 34.36 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 122.471 2.396 . . . . 0.0 110.644 -176.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . 0.448 HD21 ' HA ' ' A' ' 705' ' ' VAL . 57.5 tp -56.15 -14.93 3.05 Favored 'General case' 0 CA--C 1.562 1.429 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.554 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.273 1.5 t -53.75 -54.17 21.37 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -72.36 -28.87 63.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 122.566 1.174 . . . . 0.0 108.289 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.71 -19.21 27.32 Favored Glycine 0 C--N 1.339 0.726 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.181 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 79.8 p -57.36 -37.32 72.41 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.51 -47.49 85.38 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.13 -35.8 76.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.764 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.24 -45.34 93.76 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.292 0.568 . . . . 0.0 110.275 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.29 -36.88 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -69.45 -30.81 68.81 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.236 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.558 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 79.2 m-20 -57.9 -49.22 77.47 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.614 -0.679 . . . . 0.0 109.938 -178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -70.8 -43.42 68.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.019 0.528 . . . . 0.0 112.256 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 10.6 mt -68.73 -46.28 69.32 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 121.595 0.712 . . . . 0.0 112.565 -178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -63.23 -25.4 68.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.292 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 61.6 p -74.3 -45.15 49.42 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.572 -0.705 . . . . 0.0 111.158 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.33 -55.52 13.49 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.43 -49.14 4.53 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.709 0.766 . . . . 0.0 112.173 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 5.4 tt 82.98 -78.18 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.875 0.87 . . . . 0.0 111.644 -178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -109.99 -70.65 0.8 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.624 -0.672 . . . . 0.0 111.568 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.9 m -97.86 144.41 27.47 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.142 0.496 . . . . 0.0 110.604 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -60.98 -29.54 69.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.997 0.427 . . . . 0.0 110.419 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -55.94 -36.65 68.0 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.882 0.849 . . . . 0.0 109.226 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.91 -29.6 60.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.671 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 29.5 tp -59.65 -43.53 93.87 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -59.53 -40.04 85.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.574 0.702 . . . . 0.0 109.394 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -68.0 -45.37 74.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.83 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -38.41 91.05 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.392 0.615 . . . . 0.0 110.707 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.33 -39.88 88.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.9 -0.5 . . . . 0.0 111.168 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.9 mt -67.19 -40.64 86.55 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 17.8 pt -60.26 -36.93 71.69 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.56 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 35.2 t -55.59 -46.41 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.774 -0.579 . . . . 0.0 109.597 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -41.53 97.63 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.188 0.518 . . . . 0.0 110.856 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.87 72.49 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.44 -36.75 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 O-C-N 121.714 -0.616 . . . . 0.0 111.078 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 13.4 m -54.73 -40.26 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 O-C-N 121.471 -0.768 . . . . 0.0 111.46 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -65.28 -42.0 93.6 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.68 0.753 . . . . 0.0 111.178 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.9 tp -69.15 -38.79 78.95 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.327 0.584 . . . . 0.0 111.035 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -22.3 47.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.871 0.367 . . . . 0.0 111.312 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.09 -39.75 12.58 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.9 128.59 35.36 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.493 0.663 . . . . 0.0 110.48 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 12.7 ttp-105 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.08 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.557 0.694 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.9 mp 61.02 103.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.575 0.702 . . . . 0.0 110.556 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -167.11 175.16 7.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.511 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -53.59 -41.41 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.549 0.69 . . . . 0.0 110.363 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -73.31 -31.46 64.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.68 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -46.78 50.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.347 0.594 . . . . 0.0 110.777 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -64.38 -46.28 84.05 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.589 0.709 . . . . 0.0 110.394 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.37 -24.43 67.64 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.4 t -63.18 -35.01 78.89 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.229 0.537 . . . . 0.0 110.923 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.84 -28.12 67.22 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.211 0.529 . . . . 0.0 111.233 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -62.23 -23.53 66.71 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.048 0.452 . . . . 0.0 111.379 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -88.04 -26.6 22.49 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.238 0.542 . . . . 0.0 111.512 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -59.16 -49.11 79.12 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 111.014 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 59.3 41.34 20.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.799 0.809 . . . . 0.0 110.644 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -153.64 -71.33 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.802 -0.561 . . . . 0.0 111.224 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -65.68 -37.21 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 O-C-N 121.869 -0.519 . . . . 0.0 111.344 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.26 -33.72 43.02 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -64.01 -49.88 70.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.439 0.638 . . . . 0.0 110.116 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -65.68 -39.86 91.75 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.828 0.823 . . . . 0.0 109.622 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.6 80.92 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -102.02 -31.2 10.77 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -68.81 -27.01 65.47 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.514 -0.741 . . . . 0.0 111.481 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.7 pp -60.42 -36.08 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 O-C-N 122.091 -0.381 . . . . 0.0 110.889 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -47.23 70.51 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.281 0.563 . . . . 0.0 110.044 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 3.0 mp -76.06 -36.95 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -28.58 67.49 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.43 -44.78 96.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.54 -43.76 98.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.29 -37.86 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.433 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . 0.407 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 42.4 t -55.81 -39.44 56.23 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -63.63 -27.46 71.02 Favored Glycine 0 CA--C 1.543 1.842 0 O-C-N 121.766 -0.584 . . . . 0.0 112.273 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 46.6 m -60.55 -44.55 96.0 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.421 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.43 -31.55 69.39 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 121.597 -0.69 . . . . 0.0 112.068 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.421 ' H ' HD11 ' B' ' 692' ' ' LEU . 1.0 OUTLIER -57.16 -44.69 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 O-C-N 121.438 -0.789 . . . . 0.0 109.237 -177.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.04 -32.07 80.94 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.54 -36.86 67.23 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.785 0.803 . . . . 0.0 109.89 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.1 mmt180 -54.67 -27.68 41.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . 0.429 HG22 HD11 ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.17 -36.02 55.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 O-C-N 120.85 -1.156 . . . . 0.0 109.325 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 3.0 p -61.78 -30.5 48.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 O-C-N 121.218 -0.926 . . . . 0.0 110.424 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 11.6 m-85 -56.62 -31.41 64.28 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.708 -0.62 . . . . 0.0 110.429 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.34 88.06 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.17 -38.78 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.13 -39.95 91.94 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.363 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -68.37 -33.59 74.54 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.579 0.704 . . . . 0.0 110.01 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -42.78 93.09 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.158 0.98 . . . . 0.0 108.956 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.16 -45.13 77.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 122.153 0.977 . . . . 0.0 109.176 178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.53 -36.59 83.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.336 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 18.3 ttm180 -62.07 -47.12 86.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.25 1.024 . . . . 0.0 109.485 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.6 t -70.28 -44.4 77.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.038 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.47 -44.97 95.34 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.558 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.4 pt20 -104.46 -24.46 13.04 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.11 176.18 14.35 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -96.03 -65.05 1.0 Allowed 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.727 -0.867 . . . . 0.0 111.596 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 713' ' ' SER . . . . . 0.409 ' HA ' HG23 ' A' ' 708' ' ' VAL . 42.9 p -69.48 159.61 82.82 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.353 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -31.63 142.3 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.361 2.041 . . . . 0.0 113.152 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.448 ' O ' ' C ' ' B' ' 716' ' ' SER . 8.3 tt -95.2 -18.9 20.5 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 715' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 122.326 1.06 . . . . 0.0 112.505 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.464 0.65 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -57.99 -26.32 62.2 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.332 0.587 . . . . 0.0 112.369 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -52.34 63.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 9.9 ptt85 -77.72 -34.47 52.66 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -45.06 90.6 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.093 -1.004 . . . . 0.0 108.809 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -71.46 -34.05 69.87 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.283 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 4.3 p -57.28 -38.29 73.7 Favored 'General case' 0 C--N 1.344 0.342 0 O-C-N 122.075 -0.391 . . . . 0.0 110.601 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 28.5 mt -54.1 -19.87 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.553 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 3.0 ttt85 -59.85 -29.68 68.45 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.69 -18.67 8.57 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 122.109 -0.37 . . . . 0.0 110.063 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 43.9 t -56.04 -54.53 26.09 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -73.07 -22.11 60.66 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.27 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.9 -19.84 31.21 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.228 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 6.9 m -58.25 -37.47 74.99 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.799 -0.824 . . . . 0.0 108.968 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.4 tp -66.01 -51.02 62.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.299 0.571 . . . . 0.0 109.757 178.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.37 -36.38 83.83 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.96 -45.0 94.07 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.854 -0.529 . . . . 0.0 111.005 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -65.14 -34.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.711 0.767 . . . . 0.0 109.032 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.5 -30.29 68.11 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.724 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -55.33 -47.96 74.89 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.323 -0.861 . . . . 0.0 109.446 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.35 -45.25 66.49 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.105 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.4 mt -66.73 -46.5 75.28 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -66.65 -22.76 66.1 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 11.8 t -76.82 -45.1 29.9 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.521 0.677 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 5.1 mp -66.77 -54.6 21.11 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.9 p -98.56 -23.39 15.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -177.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 5.2 mp 70.37 -66.9 0.26 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 121.731 -0.606 . . . . 0.0 110.996 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -130.22 -67.06 0.75 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.783 -0.573 . . . . 0.0 110.997 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 7.3 m -97.66 146.44 25.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.332 0.587 . . . . 0.0 110.739 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.98 -31.96 70.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.939 0.4 . . . . 0.0 110.599 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -53.67 -39.08 64.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.822 0.82 . . . . 0.0 109.542 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.57 -29.65 64.62 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.279 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 5.7 tt -59.5 -43.26 93.38 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -37.27 75.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.67 -48.74 75.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -38.12 77.95 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 121.82 0.819 . . . . 0.0 110.05 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.28 -36.66 73.62 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 121.784 -0.573 . . . . 0.0 110.507 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.32 -31.28 67.23 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 22.5 pt -70.27 -36.69 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 121.471 -0.768 . . . . 0.0 109.792 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 39.2 t -55.53 -46.04 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 121.666 -0.646 . . . . 0.0 111.15 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 12.4 t -63.31 -42.67 99.04 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.997 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -37.41 81.54 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.573 -0.705 . . . . 0.0 111.15 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.92 -47.14 94.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 122.05 -0.406 . . . . 0.0 111.32 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.1 -38.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.488 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.17 -46.03 89.45 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.721 0.772 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 31.2 tp -68.7 -40.55 79.98 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.975 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 1.3 tp -78.01 -16.79 57.8 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.98 0.419 . . . . 0.0 111.787 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -49.3 -37.46 24.76 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 -106.12 122.55 46.41 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 122.179 -0.601 . . . . 0.0 110.641 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.67 -179.747 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.418 0.628 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.0 mp -132.13 158.19 42.3 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.391 0.615 . . . . 0.0 111.056 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.66 166.04 2.13 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.664 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -58.37 -48.52 80.35 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.924 0.869 . . . . 0.0 110.089 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.22 -21.82 66.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.52 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -41.44 22.0 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -61.63 -46.45 89.75 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.533 0.682 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.82 -31.91 68.9 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.616 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -57.87 -38.13 75.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -61.31 -29.31 69.8 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.066 0.46 . . . . 0.0 111.764 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 41.7 m95 -59.53 -28.87 67.46 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.965 -0.46 . . . . 0.0 111.198 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -77.68 -25.1 49.27 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 122.013 -0.43 . . . . 0.0 111.748 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.22 -42.22 90.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.426 0.631 . . . . 0.0 110.579 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.2 t80 53.58 30.97 11.63 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.098 0.475 . . . . 0.0 111.833 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -151.46 -69.85 0.17 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.508 -0.745 . . . . 0.0 112.471 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -37.19 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.474 0.654 . . . . 0.0 111.515 -178.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -51.93 -33.72 38.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.462 -178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -57.08 -49.02 77.14 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.628 0.727 . . . . 0.0 109.576 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -64.78 -44.22 90.68 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 122.004 -0.435 . . . . 0.0 110.416 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.15 -36.1 82.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -98.11 -15.42 19.97 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -98.44 -11.92 21.87 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.329 -0.857 . . . . 0.0 112.295 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.454 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 6.1 pt -61.06 -36.4 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 121.788 -0.57 . . . . 0.0 110.872 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -53.45 -47.32 69.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.962 0.41 . . . . 0.0 110.132 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.9 -34.05 67.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . 0.454 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.79 -33.37 71.63 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.335 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 11.6 mm -60.64 -46.74 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.31 -39.55 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.8 -37.12 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.38 -39.74 45.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.2 -38.98 80.04 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.3 m -67.41 -38.47 84.68 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 122.237 1.018 . . . . 0.0 109.421 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.0 tp -59.74 -46.17 89.95 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.261 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -67.84 -41.61 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.044 -0.41 . . . . 0.0 111.105 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.34 -29.85 69.91 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.01 -37.6 87.83 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 122.005 0.907 . . . . 0.0 110.25 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -55.75 -28.4 55.74 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.2 tt -58.61 -35.51 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.426 -0.796 . . . . 0.0 111.532 -176.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 11.0 p -53.97 -29.94 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.469 -0.769 . . . . 0.0 110.103 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -55.99 -31.5 63.09 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.808 -0.558 . . . . 0.0 110.336 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.47 -37.68 78.84 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.13 -39.28 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.87 -37.22 86.0 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.022 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 52.6 p -62.9 -36.14 82.39 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.761 -0.587 . . . . 0.0 110.621 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -40.49 93.94 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 108.832 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.27 -43.75 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -62.38 -35.66 79.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.364 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -59.52 -51.03 71.61 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.969 0.89 . . . . 0.0 110.355 -178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -45.56 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.925 0.869 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -73.81 -38.09 64.69 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -102.63 -2.52 28.19 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 86.45 -176.13 48.03 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -139.19 -57.96 0.6 Allowed 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.585 -0.95 . . . . 0.0 112.548 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 14.9 p -81.41 149.17 64.63 Favored Pre-proline 0 C--N 1.338 0.103 0 CA-C-O 118.335 -0.84 . . . . 0.0 109.644 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -30.64 94.64 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.429 2.086 . . . . 0.0 112.566 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.52 16.78 1.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.305 -176.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 121.806 0.812 . . . . 0.0 110.34 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 121.66 0.743 . . . . 0.0 111.546 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -72.14 -26.68 62.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.848 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -61.56 -8.26 4.16 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.855 -0.528 . . . . 0.0 112.395 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 63.7 mtm-85 -71.76 -45.27 62.21 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.724 -0.61 . . . . 0.0 111.677 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.4 -38.62 77.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.877 -0.515 . . . . 0.0 109.796 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.12 -42.47 69.18 Favored 'General case' 0 N--CA 1.457 -0.084 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.2 p -58.35 -43.09 88.17 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 122.088 -0.383 . . . . 0.0 110.935 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.3 -21.03 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 O-C-N 121.667 -0.645 . . . . 0.0 109.448 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -59.74 -26.3 65.54 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 109.097 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.5 -24.25 30.48 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.861 0.362 . . . . 0.0 110.104 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.66 -54.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.35 0.627 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -72.3 -24.93 61.4 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.892 0.853 . . . . 0.0 109.19 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.33 -20.75 37.89 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.905 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 1.9 m -58.81 -37.92 77.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.921 0.86 . . . . 0.0 109.775 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 19.1 tp -67.04 -51.42 55.0 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.479 0.657 . . . . 0.0 109.935 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.93 -34.84 78.88 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.413 0.625 . . . . 0.0 111.828 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.36 -45.11 92.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.101 0.477 . . . . 0.0 110.867 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.04 -34.83 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.517 0.675 . . . . 0.0 109.427 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.26 -30.76 68.94 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -55.76 -49.07 74.11 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 121.033 -1.042 . . . . 0.0 109.987 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -70.47 -44.77 67.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.448 0.642 . . . . 0.0 111.648 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -40.92 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -78.85 -35.57 43.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 15.4 p -64.54 -45.39 87.38 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.628 -0.67 . . . . 0.0 111.276 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -55.79 10.85 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.1 m -99.28 -49.53 4.43 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.419 -0.801 . . . . 0.0 112.67 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 8.7 tp 80.31 106.26 0.07 Allowed 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.884 0.849 . . . . 0.0 110.348 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 70.65 -68.26 0.22 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.64 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 3.3 m -144.47 179.66 7.12 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.356 0.598 . . . . 0.0 111.518 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.5 -162.32 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 11.1 t60 75.78 -59.81 0.51 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -61.96 -30.2 70.76 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.568 177.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.77 -32.59 70.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -35.09 68.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -69.45 -34.47 74.46 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -38.04 77.52 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.004 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.99 -37.01 73.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.648 0.737 . . . . 0.0 109.666 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.12 -38.99 60.88 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.643 0.735 . . . . 0.0 109.584 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 82.7 mt -59.06 -45.47 92.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.853 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 31.1 m -58.54 -44.11 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.313 -0.867 . . . . 0.0 111.42 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 82.3 p -63.89 -46.19 85.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -31.76 72.11 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.133 0.492 . . . . 0.0 111.576 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 58.7 mt -63.89 -47.1 92.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.24 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 33.1 m -54.09 -37.89 36.46 Favored 'Isoleucine or valine' 0 C--N 1.35 0.625 0 CA-C-N 119.72 1.145 . . . . 0.0 110.047 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -65.35 -46.38 80.45 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.413 0.625 . . . . 0.0 110.767 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 52.9 tp -70.52 -44.94 66.54 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 744' ' ' ARG . 27.7 tp -88.08 -10.99 48.41 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.552 -0.717 . . . . 0.0 110.987 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.62 -33.48 4.66 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 121.8 -0.563 . . . . 0.0 111.988 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.26 107.41 14.38 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.995 -0.709 . . . . 0.0 109.486 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 117.921 -1.037 . . . . 0.0 110.734 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt -177.08 101.52 0.05 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.543 0.687 . . . . 0.0 109.676 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -173.65 -169.17 0.48 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.165 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.4 tt -48.02 -39.53 20.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.379 0.609 . . . . 0.0 110.821 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.48 -37.08 71.34 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -41.73 51.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.558 0.694 . . . . 0.0 110.739 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -75.15 -45.76 38.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.842 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.17 -35.28 76.13 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.021 0.439 . . . . 0.0 111.907 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.0 m -64.17 -31.03 72.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.526 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 12.4 tp -63.42 -31.14 72.22 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.977 -0.452 . . . . 0.0 111.698 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -59.73 -29.84 68.41 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.778 -0.576 . . . . 0.0 111.08 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -25.57 68.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.183 0.516 . . . . 0.0 111.168 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -60.99 -40.54 93.86 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.59 0.71 . . . . 0.0 110.278 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 23.8 t80 56.34 35.01 25.15 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.559 0.695 . . . . 0.0 111.235 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -155.41 -64.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.714 -0.617 . . . . 0.0 111.649 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.1 tp -68.22 -37.28 77.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 122.061 -0.399 . . . . 0.0 111.568 -179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.56 -33.69 46.91 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 122.095 -0.378 . . . . 0.0 111.727 -178.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -65.88 -49.76 66.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.299 0.571 . . . . 0.0 110.686 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -65.26 -44.6 87.57 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.509 0.671 . . . . 0.0 109.352 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.35 -35.61 81.48 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.964 -0.46 . . . . 0.0 111.729 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -93.28 -14.97 26.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -93.37 -12.95 28.73 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.608 -0.682 . . . . 0.0 111.787 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.1 pp -60.79 -36.57 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 O-C-N 121.872 -0.517 . . . . 0.0 110.442 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.3 ttt-85 -53.77 -47.43 70.74 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.613 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.5 mp -73.84 -35.12 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -27.78 65.26 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.612 -177.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 14.9 mm -60.88 -42.09 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 121.513 0.673 . . . . 0.0 109.247 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 77.2 mt -71.04 -36.75 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.072 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.8 mm -58.6 -37.31 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 O-C-N 122.043 -0.411 . . . . 0.0 109.996 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 98.8 t -54.44 -42.01 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.76 -41.51 66.46 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -65.92 -38.71 89.39 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.834 0.826 . . . . 0.0 109.714 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -45.86 91.16 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.947 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.76 -42.0 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.785 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.42 -24.57 61.74 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.47 -39.22 86.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.014 0.911 . . . . 0.0 109.459 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -56.22 -28.44 58.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.889 0.875 . . . . 0.0 112.812 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.1 -37.21 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 O-C-N 121.17 -0.956 . . . . 0.0 108.67 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.69 -30.65 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 O-C-N 121.533 -0.729 . . . . 0.0 110.239 176.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -55.89 -28.99 59.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.071 0.463 . . . . 0.0 110.405 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.47 -37.0 72.2 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 4.0 m -63.58 -35.99 74.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 119.938 -0.705 . . . . 0.0 109.552 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.8 tp -61.01 -42.3 98.2 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.013 -0.429 . . . . 0.0 110.753 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 60.9 p -62.94 -35.02 78.72 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.371 0.605 . . . . 0.0 110.072 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.44 96.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 122.113 0.958 . . . . 0.0 108.852 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.39 -45.11 94.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -62.91 -36.82 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.914 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . 0.412 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 8.3 ttm180 -60.59 -47.5 85.94 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.43 0.633 . . . . 0.0 110.612 -178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.2 t -75.02 -44.37 44.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 122.188 0.995 . . . . 0.0 108.58 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -66.11 -18.71 65.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.973 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -97.22 -18.82 19.0 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.384 -0.823 . . . . 0.0 112.841 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 116.66 11.27 9.53 Favored Glycine 0 CA--C 1.54 1.601 0 O-C-N 121.385 -0.822 . . . . 0.0 112.751 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' HD3' ' A' ' 707' ' ' ARG . 0.1 OUTLIER 63.32 -121.08 0.56 Allowed 'General case' 0 CA--C 1.565 1.521 0 O-C-N 121.935 -0.744 . . . . 0.0 111.053 179.322 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 713' ' ' SER . . . . . 0.407 ' HA ' HG21 ' C' ' 708' ' ' VAL . 69.7 p -62.77 159.35 45.22 Favored Pre-proline 0 C--N 1.351 0.672 0 O-C-N 120.84 -1.163 . . . . 0.0 111.519 -178.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.67 113.72 0.43 Allowed 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 121.758 1.639 . . . . 0.0 111.758 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.12 -20.27 13.06 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.483 1.225 0 CA-C-O 122.669 1.223 . . . . 0.0 110.876 -179.037 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 122.18 0.99 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 12.4 mtt-85 -58.03 -25.47 61.2 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.759 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -10.8 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 7.1 mtm105 -70.71 -46.18 63.56 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.45 -0.782 . . . . 0.0 109.196 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -59.07 -46.1 89.14 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.191 0.52 . . . . 0.0 111.962 -178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . 0.451 ' O ' HD21 ' C' ' 785' ' ' LEU . 0.5 OUTLIER -72.41 -28.61 63.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.57 0.7 . . . . 0.0 111.67 179.537 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 12.2 p -69.51 -36.46 76.47 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.011 -1.056 . . . . 0.0 111.726 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.501 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.9 mp -66.61 -46.79 85.2 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 CA-C-O 117.058 -1.449 . . . . 0.0 114.0 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.503 ' HB2' ' HB3' ' C' ' 785' ' ' LEU . 0.0 OUTLIER -80.45 -13.09 59.41 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 122.715 2.507 . . . . 0.0 109.453 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.1 -17.23 38.4 Favored 'General case' 0 C--N 1.363 1.187 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 172.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.3 p -57.63 -44.82 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -70.9 -13.19 61.93 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 122.116 0.96 . . . . 0.0 109.447 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.11 -18.95 21.66 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 124.167 0.889 . . . . 0.0 111.329 -178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 70.6 p -57.38 -37.3 72.45 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 117.645 0.722 . . . . 0.0 109.06 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.93 -51.05 69.67 Favored 'General case' 0 C--N 1.346 0.414 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.86 -35.25 72.66 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.892 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.3 -44.99 92.49 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -61.71 -36.21 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.02 -30.56 70.68 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.625 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.409 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 13.2 m-20 -56.09 -50.15 71.83 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.407 -0.808 . . . . 0.0 109.154 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -71.49 -45.15 63.27 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.686 0.755 . . . . 0.0 111.624 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 1.4 tt -61.53 -38.99 89.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.652 0.739 . . . . 0.0 112.359 -177.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 13.5 ttm105 -82.59 -17.98 42.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 15.9 p -76.23 -46.16 29.48 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.481 -0.762 . . . . 0.0 112.706 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -54.37 16.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 5.1 t -97.86 -49.51 4.78 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.039 0.923 . . . . 0.0 111.556 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 7.9 tt 75.77 -71.3 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.298 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -108.4 -66.31 1.05 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.724 -0.61 . . . . 0.0 111.238 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 2.0 t -104.92 134.3 48.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.076 0.465 . . . . 0.0 110.476 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -55.27 -21.63 15.25 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.981 0.419 . . . . 0.0 110.821 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -60.5 -39.92 89.46 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-O 121.726 0.774 . . . . 0.0 109.24 178.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -55.69 -29.5 59.52 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.837 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.44 -34.77 72.92 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 122.157 -0.339 . . . . 0.0 110.606 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -56.88 -32.92 66.35 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -66.13 -46.84 76.13 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.572 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.91 -38.65 79.4 Favored 'General case' 0 C--N 1.354 0.782 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.441 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 7.5 tt -63.38 -42.6 98.83 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.692 -0.63 . . . . 0.0 111.791 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 43.9 mt -74.57 -39.64 62.13 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.71 -37.44 77.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.427 -178.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 18.4 m -60.4 -42.86 92.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.571 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.028 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 24.2 p -63.79 -44.67 92.68 Favored 'General case' 0 C--N 1.343 0.303 0 O-C-N 122.042 -0.412 . . . . 0.0 111.768 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -33.69 76.13 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.6 mt -54.97 -37.1 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 O-C-N 121.911 -0.493 . . . . 0.0 110.663 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 14.6 m -54.76 -38.15 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 O-C-N 121.209 -0.932 . . . . 0.0 109.69 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.16 -45.36 92.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.555 0.693 . . . . 0.0 110.753 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.89 -43.88 86.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.236 0.541 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -22.5 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.921 0.391 . . . . 0.0 111.509 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.07 -38.09 5.98 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -108.92 121.86 46.01 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.56 0.695 . . . . 0.0 110.485 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.593 -179.843 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 120.457 0.17 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 176.53 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -176.01 -179.35 1.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.634 0.731 . . . . 0.0 110.924 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -39.05 72.84 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.498 0.666 . . . . 0.0 109.837 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.12 -34.22 77.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.344 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -75.22 -47.12 29.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.087 0.47 . . . . 0.0 110.379 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -68.24 -46.0 71.69 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.501 0.667 . . . . 0.0 111.439 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.64 -19.21 65.82 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.045 -178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.8 66.24 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.063 -0.398 . . . . 0.0 111.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.78 -36.32 78.68 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -59.9 -17.26 35.83 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.846 -0.534 . . . . 0.0 111.239 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -27.17 24.79 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.16 0.505 . . . . 0.0 110.205 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -64.04 -46.62 83.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.545 0.688 . . . . 0.0 110.431 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 21.0 t80 57.65 31.84 20.97 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.517 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -142.93 -70.41 0.33 Allowed 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.719 -0.613 . . . . 0.0 110.907 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.95 -37.5 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.05 -0.406 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.5 -33.87 46.92 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -65.67 -50.32 65.37 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.712 -0.617 . . . . 0.0 110.701 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -65.76 -42.45 90.88 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 122.017 0.913 . . . . 0.0 109.76 178.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -39.17 93.8 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.14 -178.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -97.15 -28.2 14.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -77.11 -15.59 59.5 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.468 -0.77 . . . . 0.0 111.901 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.487 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 5.9 pt -60.78 -37.35 75.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.894 -0.504 . . . . 0.0 111.006 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -53.66 -47.35 70.45 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.912 0.387 . . . . 0.0 110.805 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -70.64 -35.17 59.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.487 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.97 -27.89 67.2 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.205 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 18.1 mm -60.62 -48.2 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 O-C-N 121.827 -0.546 . . . . 0.0 109.789 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -64.88 -41.1 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.99 -38.06 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.22 -44.3 98.94 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.18 -26.7 9.5 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 13.7 m -60.52 -46.11 91.37 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.41 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.82 -32.89 71.07 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.364 -0.835 . . . . 0.0 112.504 -177.558 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.41 ' H ' HD11 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -58.99 -47.02 91.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.96 -27.21 66.66 Favored Glycine 0 CA--C 1.541 1.699 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -37.25 77.34 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.04 0.924 . . . . 0.0 110.089 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 12.8 mmt180 -55.39 -27.85 50.3 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -179.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.74 -36.86 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 O-C-N 121.028 -1.045 . . . . 0.0 109.01 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.41 -30.69 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 O-C-N 121.722 -0.611 . . . . 0.0 110.327 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.0 m-85 -56.49 -31.26 63.89 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.871 -0.518 . . . . 0.0 110.153 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.61 78.7 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -37.73 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.665 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.5 tp -56.86 -37.92 71.99 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.761 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 51.0 m -62.83 -36.15 82.25 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.18 0.514 . . . . 0.0 110.837 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -44.85 90.34 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 122.238 1.018 . . . . 0.0 108.826 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 76.9 t -65.36 -45.14 94.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 122.522 1.153 . . . . 0.0 109.211 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -62.69 -35.87 81.08 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.557 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -65.74 -49.41 68.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.488 0.661 . . . . 0.0 112.323 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -44.17 31.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.25 -45.35 91.43 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -175.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.409 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 2.4 pt20 -104.67 -24.56 12.94 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.67 177.31 14.84 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -113.43 -62.68 1.56 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.736 -0.861 . . . . 0.0 112.804 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 8.4 p -62.76 159.3 45.5 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.388 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -29.81 108.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 122.76 2.307 . . . . 0.0 112.961 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.9 tt -67.02 -16.72 64.54 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 121.763 0.792 . . . . 0.0 109.547 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.488 0.661 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -58.6 -26.86 64.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.167 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -55.72 -12.28 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -68.41 -40.97 81.08 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.563 -0.711 . . . . 0.0 111.567 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -58.5 -41.14 84.69 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.506 -0.746 . . . . 0.0 110.664 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.26 -36.96 71.95 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.244 0.545 . . . . 0.0 110.021 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 8.9 p -56.96 -46.22 82.31 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 122.056 -0.402 . . . . 0.0 110.44 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.8 mp -53.34 -19.22 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.081 179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -28.13 66.61 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 4.2 pp -55.61 -21.29 16.94 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.941 0.401 . . . . 0.0 110.374 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 48.4 t -55.61 -53.95 31.11 Favored 'Isoleucine or valine' 0 C--N 1.35 0.596 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -72.61 -22.66 60.93 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.689 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.23 -20.68 36.85 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.999 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 18.4 m -59.5 -38.97 82.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 117.884 0.842 . . . . 0.0 109.631 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 16.9 tp -67.89 -51.18 51.0 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.436 0.636 . . . . 0.0 109.995 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.55 81.0 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.3 0.571 . . . . 0.0 111.513 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 5.7 tt -60.81 -45.49 94.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.903 0.382 . . . . 0.0 111.618 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 54.8 mt -65.64 -37.32 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 121.654 0.74 . . . . 0.0 109.229 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.13 -30.06 68.24 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.673 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -55.35 -46.91 76.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.531 -0.731 . . . . 0.0 109.767 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.36 -45.23 66.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-O 121.063 0.458 . . . . 0.0 112.166 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 43.4 mt -69.2 -45.35 70.13 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.475 0.655 . . . . 0.0 112.748 -178.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -60.86 -43.19 98.7 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.8 m -59.69 -42.97 94.16 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.413 -0.805 . . . . 0.0 111.323 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -54.23 20.01 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.81 -48.11 5.32 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.653 0.739 . . . . 0.0 112.051 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 78.21 -54.74 0.49 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.654 0.782 . . . . 0.0 111.343 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -137.51 119.46 15.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 111.236 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 16.7 m 54.02 177.3 0.02 OUTLIER 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.147 0.499 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -97.49 -2.11 42.67 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.958 -0.464 . . . . 0.0 111.621 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -74.3 -43.15 57.99 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -62.24 -29.96 70.76 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.262 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.79 -31.08 69.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -56.94 -35.61 69.28 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.466 0.651 . . . . 0.0 109.425 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -69.02 -34.93 76.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.311 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -37.95 76.51 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.023 0.439 . . . . 0.0 110.576 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.34 -36.54 73.58 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 0.0 111.65 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.35 -48.09 71.37 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.775 -0.578 . . . . 0.0 111.623 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 17.4 pt -56.35 -34.94 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 O-C-N 122.004 -0.435 . . . . 0.0 110.4 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 56.2 t -53.44 -43.16 51.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.06 -36.49 84.18 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.75 0.786 . . . . 0.0 110.22 177.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -63.33 -36.43 83.65 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.155 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 3.7 mm -54.79 -55.45 15.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 O-C-N 122.11 -0.369 . . . . 0.0 110.933 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 31.3 m -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.39 0.614 . . . . 0.0 110.355 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.98 -42.05 99.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.196 0.522 . . . . 0.0 111.474 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 12.1 tp -68.66 -39.43 80.64 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.956 0.884 . . . . 0.0 110.226 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.99 -23.0 52.29 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.459 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.58 -54.62 8.74 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.32 125.4 37.9 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.402 0.62 . . . . 0.0 110.323 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.632 -179.474 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.385 0.612 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 7.1 mp 56.84 102.71 0.02 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 121.587 0.708 . . . . 0.0 110.585 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -164.13 171.07 15.57 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.717 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 10.5 tt -51.93 -61.93 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.588 0.708 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.81 -16.61 63.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.279 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -81.22 -46.15 15.25 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 122.06 -0.4 . . . . 0.0 111.194 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -64.84 -45.98 83.82 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.667 0.746 . . . . 0.0 110.013 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.32 -21.21 66.25 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.431 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 48.4 t -69.63 -29.69 67.24 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.884 -0.51 . . . . 0.0 111.483 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.85 -37.66 79.91 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.129 0.49 . . . . 0.0 110.795 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -59.87 -18.94 48.29 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 111.297 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -81.21 -28.33 34.94 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.425 0.631 . . . . 0.0 110.777 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -60.05 -46.51 89.3 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.586 0.708 . . . . 0.0 110.209 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.23 36.62 27.62 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.428 0.632 . . . . 0.0 111.66 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.6 -73.36 0.14 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.734 -0.604 . . . . 0.0 111.772 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -37.33 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.366 0.603 . . . . 0.0 111.608 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.76 -33.72 36.23 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.918 -0.488 . . . . 0.0 111.983 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -60.63 -50.19 74.52 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.721 -0.612 . . . . 0.0 109.665 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -65.67 -40.08 92.02 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 121.761 0.791 . . . . 0.0 109.815 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -35.78 81.93 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -104.91 -20.52 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -176.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -86.97 -12.94 46.04 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.48 -0.763 . . . . 0.0 112.159 -179.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.1 pp -60.75 -36.35 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 122.033 -0.417 . . . . 0.0 110.329 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -53.9 -47.1 71.48 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.934 0.397 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.34 -36.35 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -33.73 72.12 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.955 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 7.8 mm -60.95 -52.01 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.074 0.464 . . . . 0.0 110.083 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 61.3 mt -62.84 -37.07 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 121.709 0.766 . . . . 0.0 108.934 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.57 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.7 t -55.16 -40.03 53.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.65 -39.49 75.86 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -67.66 -38.77 84.23 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.976 0.893 . . . . 0.0 109.384 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -46.33 90.2 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.224 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -65.27 -41.91 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 121.353 0.596 . . . . 0.0 109.848 -178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.76 -25.9 64.3 Favored Glycine 0 CA--C 1.539 1.588 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -58.38 -37.8 75.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.723 0.773 . . . . 0.0 110.271 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -55.44 -28.71 56.02 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.1 tt -58.79 -36.44 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 120.874 -1.141 . . . . 0.0 111.804 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.8 p -59.1 -30.39 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.271 -0.893 . . . . 0.0 110.19 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -56.41 -30.71 63.11 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.839 -0.538 . . . . 0.0 110.18 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.81 -37.78 77.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -44.33 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.97 -36.95 75.7 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.72 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 66.6 m -62.05 -37.26 84.29 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -40.91 95.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 122.0 0.905 . . . . 0.0 108.779 178.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.69 -44.98 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.693 178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -62.79 -36.29 82.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.49 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.58 -48.69 78.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.8 0.81 . . . . 0.0 110.296 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . 0.407 HG21 ' HA ' ' A' ' 713' ' ' SER . 1.2 t -76.0 -43.96 38.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.978 -178.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -73.07 -36.23 66.82 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.482 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -102.48 -7.66 21.72 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 99.83 166.29 29.34 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -110.83 -63.0 1.45 Allowed 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.715 -0.874 . . . . 0.0 111.681 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 76.3 p -90.57 159.62 40.73 Favored Pre-proline 0 C--O 1.234 0.273 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.209 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_exo -38.93 119.32 0.43 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.561 1.508 . . . . 0.0 111.801 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 3.0 tt -96.47 4.52 52.05 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -175.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.928 0.87 . . . . 0.0 112.047 -179.449 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 . . . . . 0 C--O 1.234 0.274 0 CA-C-O 122.172 0.987 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -65.67 -26.71 67.91 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.584 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -55.98 -15.21 3.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . 0.402 ' HA ' ' OG ' ' C' ' 745' ' ' SER . 45.6 mtm-85 -56.06 -33.45 65.02 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.82 -0.55 . . . . 0.0 110.8 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -58.28 -40.25 81.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.618 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -47.83 54.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.058 0.456 . . . . 0.0 110.455 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 745' ' ' SER . . . . . 0.402 ' OG ' ' HA ' ' C' ' 742' ' ' ARG . 2.3 p -57.01 -34.88 68.6 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -23.23 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 O-C-N 121.658 -0.651 . . . . 0.0 109.856 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -60.18 -24.35 64.69 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.553 0.692 . . . . 0.0 110.069 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.37 -26.34 67.77 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.904 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 82.3 t -55.81 -53.91 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -72.69 -22.84 60.84 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.588 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -22.88 46.66 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.906 -177.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 38.1 t -61.2 -41.2 96.41 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.832 -0.805 . . . . 0.0 109.543 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.9 tp -68.12 -46.23 71.48 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 109.938 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.98 -35.56 81.1 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.689 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -60.0 -45.43 92.76 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.268 0.556 . . . . 0.0 110.72 -178.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . 0.408 HD11 HG21 ' C' ' 756' ' ' ILE . 45.5 mm -67.43 -40.95 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.138 0.97 . . . . 0.0 108.723 178.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.44 -30.34 71.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.529 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -55.24 -44.0 75.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.552 -0.717 . . . . 0.0 110.892 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.13 -45.12 67.5 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.309 0.576 . . . . 0.0 110.891 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 26.9 mt -67.26 -40.22 86.2 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -67.29 -50.63 59.55 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 1.3 m -68.35 -43.3 77.74 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.228 1.013 . . . . 0.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.55 -52.68 56.41 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.96 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.79 -34.02 11.04 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.127 -0.983 . . . . 0.0 113.418 -177.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.03 177.25 0.24 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -38.14 -66.3 0.27 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 30.9 m -97.17 162.01 13.55 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.853 -0.529 . . . . 0.0 110.649 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.29 -29.7 62.9 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.839 0.352 . . . . 0.0 110.676 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -53.83 -32.04 51.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.815 0.817 . . . . 0.0 109.471 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 -69.91 -30.54 67.97 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.04 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.4 -43.39 96.73 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -56.78 -36.97 70.47 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.494 0.664 . . . . 0.0 109.428 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -69.17 -39.42 78.75 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.23 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.12 -38.11 89.61 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 121.087 0.47 . . . . 0.0 110.855 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 5.7 mp -58.4 -37.79 76.02 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.269 0.557 . . . . 0.0 110.256 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 57.4 mt -74.81 -36.72 62.45 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.486 0.66 . . . . 0.0 110.06 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 40.2 mt -61.26 -47.88 91.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.719 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.06 -39.33 57.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 O-C-N 121.641 -0.662 . . . . 0.0 111.182 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 779' ' ' THR . . . . . 0.404 ' O ' HG21 ' C' ' 782' ' ' VAL . 4.2 m -61.01 -47.95 84.08 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.402 -0.811 . . . . 0.0 110.978 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -68.23 -36.53 79.64 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.809 -0.557 . . . . 0.0 111.535 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.93 -38.23 44.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 CA-C-O 118.644 -0.693 . . . . 0.0 111.954 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.404 HG21 ' O ' ' C' ' 779' ' ' THR . 14.2 m -53.2 -36.79 26.26 Favored 'Isoleucine or valine' 0 C--N 1.354 0.787 0 CA-C-N 120.169 1.35 . . . . 0.0 109.092 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -64.27 -41.62 96.83 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.344 -0.848 . . . . 0.0 110.688 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.94 -44.38 69.69 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.503 ' HB3' ' HB2' ' A' ' 747' ' ' ARG . 21.3 tp -79.53 -26.92 41.36 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.273 -0.892 . . . . 0.0 109.771 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -48.65 -33.7 12.96 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -102.48 129.21 48.93 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.255 0.55 . . . . 0.0 109.887 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.506 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 37.4 mt 61.46 113.23 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.598 0.713 . . . . 0.0 110.306 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -177.55 179.11 0.96 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.75 -41.81 67.51 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.365 0.603 . . . . 0.0 110.367 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -73.71 -32.87 64.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -78.01 -44.36 26.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.135 0.493 . . . . 0.0 111.199 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -65.04 -45.3 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.189 0.518 . . . . 0.0 110.475 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.35 -20.91 65.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.223 0.535 . . . . 0.0 111.362 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.8 t -65.17 -39.4 92.88 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.89 -27.69 66.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.039 0.447 . . . . 0.0 111.873 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.0 m95 -60.18 -24.6 64.9 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.822 -0.549 . . . . 0.0 112.132 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.61 -15.59 39.3 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.651 -0.655 . . . . 0.0 111.861 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -65.66 -45.98 80.89 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.497 0.665 . . . . 0.0 110.378 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 45.9 t80 58.42 42.49 21.16 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -161.02 -69.28 0.06 Allowed 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.653 -0.654 . . . . 0.0 111.733 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.33 -36.7 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 122.095 -0.378 . . . . 0.0 111.923 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 6.9 m -52.04 -34.5 43.6 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -65.83 -50.07 65.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.381 0.61 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -65.72 -44.13 86.99 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.698 0.761 . . . . 0.0 110.345 178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -36.0 82.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -95.51 -42.82 8.26 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -70.69 -3.71 19.9 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.557 -0.715 . . . . 0.0 112.755 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.91 -36.66 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.672 -0.642 . . . . 0.0 110.038 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 9.7 ttt-85 -56.99 -47.13 81.53 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.177 0.513 . . . . 0.0 110.478 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.59 -33.2 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -28.48 69.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.584 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.0 mm -60.95 -48.07 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.292 0.568 . . . . 0.0 109.656 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 80.1 mt -60.36 -36.94 72.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.09 -38.35 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -55.21 -40.86 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.88 -33.27 77.74 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -66.73 -38.71 87.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.95 0.881 . . . . 0.0 110.998 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -46.03 90.69 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -61.43 -41.65 90.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 O-C-N 121.716 -0.615 . . . . 0.0 109.764 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.22 -39.76 97.62 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 178.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.43 -40.37 96.35 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.869 0.842 . . . . 0.0 109.7 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -28.08 55.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.66 0.784 . . . . 0.0 112.188 179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.9 -34.8 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.551 -0.718 . . . . 0.0 109.41 -177.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 5.1 p -53.81 -29.1 17.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 O-C-N 121.534 -0.729 . . . . 0.0 110.307 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -54.77 -28.68 50.53 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.808 -0.558 . . . . 0.0 110.504 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -36.57 70.19 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.3 m -61.29 -35.83 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 CA-C-O 121.674 0.75 . . . . 0.0 109.474 177.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.74 -41.95 96.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.11 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 56.3 p -62.48 -31.92 72.74 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.641 0.734 . . . . 0.0 109.679 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.48 -47.14 87.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.662 1.22 . . . . 0.0 108.667 177.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 80.7 t -64.63 -45.15 96.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.363 -1.289 . . . . 0.0 109.29 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 7.8 m120 -62.31 -36.98 83.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 38.3 ttm105 -57.57 -48.46 79.29 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.725 -1.235 . . . . 0.0 110.083 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.5 t -76.42 -44.45 35.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.404 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.98 -16.03 61.08 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . 0.498 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 1.8 tt0 -101.26 -8.45 22.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.031 -1.043 . . . . 0.0 113.468 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.38 18.1 10.68 Favored Glycine 0 CA--C 1.541 1.664 0 O-C-N 121.824 -0.548 . . . . 0.0 112.55 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 54.13 -125.03 2.27 Favored 'General case' 0 CA--C 1.566 1.567 0 O-C-N 121.831 -0.805 . . . . 0.0 110.243 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.13 159.71 36.4 Favored Pre-proline 0 C--N 1.353 0.734 0 O-C-N 120.754 -1.216 . . . . 0.0 109.689 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -45.4 104.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 121.177 1.251 . . . . 0.0 111.56 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.24 -20.33 16.65 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -177.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.549 0.909 0 CA-C-O 122.24 1.019 . . . . 0.0 111.052 -179.769 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.708 0.766 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -57.84 -25.28 60.47 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.001 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -12.33 0.68 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -177.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -42.26 89.18 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.479 -0.763 . . . . 0.0 109.021 177.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -64.91 -36.1 83.27 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -36.67 77.05 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.69 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.5 p -63.76 -45.3 90.46 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 40.7 mt -55.32 -21.11 8.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.973 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.417 ' CZ ' ' HB2' ' C' ' 785' ' ' LEU . 1.9 mmp_? -59.86 -30.48 69.0 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.629 -0.669 . . . . 0.0 109.201 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.07 -16.69 53.96 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.167 0.508 . . . . 0.0 110.315 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.57 -55.12 16.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.885 0 O-C-N 120.96 -1.088 . . . . 0.0 108.123 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.96 -22.0 60.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 122.507 1.146 . . . . 0.0 108.953 174.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.72 -19.65 29.1 Favored Glycine 0 C--O 1.219 -0.843 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 88.3 p -57.98 -37.65 74.62 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.046 0.923 . . . . 0.0 109.065 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.2 tp -66.64 -51.1 60.02 Favored 'General case' 0 C--N 1.343 0.294 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.41 73.38 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.087 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.67 -45.07 90.21 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.931 -0.481 . . . . 0.0 111.696 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.73 -34.2 61.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.7 -29.48 66.9 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.941 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.523 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 20.2 m-20 -54.6 -49.02 71.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.324 -0.86 . . . . 0.0 109.686 -177.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.68 -44.93 65.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.527 0.679 . . . . 0.0 111.327 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 3.6 mt -65.74 -29.79 70.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 70.7 mtt180 -73.59 -27.79 61.48 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -45.74 39.43 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.368 -0.832 . . . . 0.0 110.446 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.96 -54.94 12.62 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 -49.19 4.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.612 0.72 . . . . 0.0 111.785 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 4.5 tt 79.21 -66.9 0.17 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.432 0.693 . . . . 0.0 110.988 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -112.64 -61.33 1.74 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.751 -0.593 . . . . 0.0 111.794 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 1.3 m -120.23 157.64 28.68 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.264 0.554 . . . . 0.0 110.732 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -21.16 66.06 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.769 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 65.0 m-70 -56.85 -42.0 78.94 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.307 1.051 . . . . 0.0 108.327 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -28.62 69.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.424 177.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -37.47 75.65 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.99 -32.89 72.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.21 -47.52 73.59 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 122.206 -0.309 . . . . 0.0 111.053 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 tp -61.13 -37.8 84.12 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.977 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 25.6 mt -58.59 -36.41 73.96 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.83 -0.544 . . . . 0.0 112.045 -177.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 32.5 mt -74.55 -48.54 26.28 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.495 -0.753 . . . . 0.0 111.632 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.9 pp -70.69 -37.36 68.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 O-C-N 122.178 -0.326 . . . . 0.0 111.619 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 9.8 p -58.71 -44.34 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 21.0 p -64.06 -35.56 81.15 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-O 122.223 1.011 . . . . 0.0 109.504 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -60.79 -45.42 94.45 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 2.7 pt -64.53 -41.94 93.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.108 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.67 -38.6 82.69 Favored 'Isoleucine or valine' 0 C--N 1.346 0.451 0 CA-C-N 119.066 0.848 . . . . 0.0 111.025 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.41 -45.6 83.32 Favored 'General case' 0 C--N 1.35 0.588 0 O-C-N 121.715 -0.616 . . . . 0.0 111.031 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -40.21 73.72 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.382 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 787' ' ' ARG . 3.6 tp -66.35 -38.16 86.99 Favored 'General case' 0 C--O 1.214 -0.792 0 O-C-N 122.06 -0.4 . . . . 0.0 110.861 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -12.97 61.15 0.0 OUTLIER Glycine 0 N--CA 1.483 1.799 0 C-N-CA 126.039 1.78 . . . . 0.0 115.251 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . 0.624 ' N ' ' O ' ' A' ' 785' ' ' LEU . 7.8 ptm180 -137.58 148.56 45.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.435 0.636 . . . . 0.0 111.279 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.933 -1.032 . . . . 0.0 110.472 179.599 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.2 mm? 54.74 96.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.554 0.692 . . . . 0.0 110.483 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -173.39 164.99 4.71 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.14 -37.64 67.22 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.471 0.653 . . . . 0.0 109.9 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -65.28 -36.92 85.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.699 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 10.9 tttm -80.63 -49.22 11.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.218 0.532 . . . . 0.0 110.125 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -56.53 -44.28 80.66 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.462 0.649 . . . . 0.0 110.029 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.66 -28.95 69.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.362 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 23.0 t -62.07 -36.82 82.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 111.242 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.78 -23.73 63.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 122.055 -0.403 . . . . 0.0 111.719 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -59.55 -29.0 67.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.32 0.581 . . . . 0.0 110.288 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.05 -7.71 56.62 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.212 0.53 . . . . 0.0 110.846 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . 0.44 ' O ' ' N ' ' B' ' 674' ' ' ASP . 14.4 m95 -94.54 34.64 1.29 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.333 0.587 . . . . 0.0 109.802 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -39.81 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 122.087 0.946 . . . . 0.0 113.35 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . 0.44 ' N ' ' O ' ' B' ' 672' ' ' TRP . 1.6 t70 177.7 -66.07 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.672 0.748 . . . . 0.0 110.134 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.69 -36.93 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.099 0.56 . . . . 0.0 112.022 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.4 m -51.6 -33.74 34.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -64.38 -50.02 69.33 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 121.744 -0.597 . . . . 0.0 109.884 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -65.64 -43.05 90.64 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.748 0.785 . . . . 0.0 109.52 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.72 80.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 15.4 t90 -100.48 -45.9 5.4 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -63.55 -7.21 6.47 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.594 -0.691 . . . . 0.0 112.398 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 1.8 pp -60.44 -36.43 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 O-C-N 121.652 -0.655 . . . . 0.0 110.418 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -53.7 -47.35 70.59 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.048 -0.408 . . . . 0.0 111.131 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.1 mp -69.01 -36.05 71.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -31.41 69.75 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.607 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 14.1 mm -60.68 -46.56 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.74 -41.45 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.29 -37.74 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 53.5 t -59.11 -40.12 80.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.89 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.23 -27.22 67.16 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.752 -0.592 . . . . 0.0 111.822 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.0 m -60.66 -41.43 95.0 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -177.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.412 ' CD1' ' O ' ' B' ' 689' ' ' VAL . 0.4 OUTLIER -59.3 -33.2 70.8 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 121.486 -0.759 . . . . 0.0 112.372 -176.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.411 ' H ' HD13 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -66.27 -40.38 86.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 121.453 -0.779 . . . . 0.0 109.896 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.89 -33.94 85.4 Favored Glycine 0 CA--C 1.543 1.807 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.81 -37.22 76.18 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.866 0.841 . . . . 0.0 110.323 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -27.5 45.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.447 1.099 . . . . 0.0 113.832 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 20.8 tt -57.71 -34.86 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.26 -0.9 . . . . 0.0 109.704 -177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 5.2 p -53.52 -28.93 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 O-C-N 121.603 -0.686 . . . . 0.0 110.002 178.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -55.39 -30.7 60.89 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.612 -0.68 . . . . 0.0 109.993 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.77 78.0 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.5 -41.13 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.78 -37.78 80.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.303 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 44.1 p -62.47 -41.69 98.95 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.57 -178.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.85 -40.58 89.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.677 0.751 . . . . 0.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.34 -43.61 87.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -62.72 -36.58 83.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.348 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -65.65 -49.39 68.82 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.703 1.239 . . . . 0.0 109.49 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 9.4 t -77.4 -45.37 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -63.91 -44.81 91.83 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -174.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.523 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 7.9 pt20 -104.59 -24.14 13.03 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.95 165.11 10.13 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -106.7 -57.28 2.08 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.195 -0.591 . . . . 0.0 112.166 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 65.7 p -74.83 159.16 83.68 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.313 -0.851 . . . . 0.0 108.792 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -32.89 124.5 0.11 Allowed 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.238 1.959 . . . . 0.0 112.376 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.6 tt -79.09 -14.93 58.84 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 121.945 0.878 . . . . 0.0 112.538 -178.798 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.628 0 CA-C-O 121.39 0.614 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -71.34 -26.5 62.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.105 0.479 . . . . 0.0 111.259 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.5 -10.58 0.67 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -56.13 -30.73 62.54 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.365 -0.834 . . . . 0.0 110.311 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.49 -41.66 97.6 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -37.17 72.21 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.567 178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 63.2 p -56.93 -36.0 69.73 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.2 mp -55.34 -18.3 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -59.48 -28.13 66.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -21.75 18.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.094 0.474 . . . . 0.0 109.856 177.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 54.1 t -55.84 -54.19 29.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -72.94 -24.48 60.81 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.436 174.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.08 33.57 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.77 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.68 -37.94 77.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.001 0.901 . . . . 0.0 108.948 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.78 -49.4 58.95 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.4 0.619 . . . . 0.0 109.762 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.41 80.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.248 0.547 . . . . 0.0 112.359 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.4 tt -60.24 -45.53 92.93 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.425 0.631 . . . . 0.0 110.882 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.73 -39.29 85.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 122.004 0.907 . . . . 0.0 108.653 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.44 68.62 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.082 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . 0.427 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 85.7 m-20 -55.15 -49.07 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.456 -0.777 . . . . 0.0 110.963 -177.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -70.3 -40.86 73.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.109 0.481 . . . . 0.0 110.809 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.1 mt -69.15 -31.06 69.47 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.6 -49.75 56.91 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.828 -0.545 . . . . 0.0 112.271 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 4.0 m -69.18 -41.07 77.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.743 0.782 . . . . 0.0 110.921 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.99 -53.31 59.31 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.471 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 23.1 t -97.35 -10.74 25.02 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.526 -0.734 . . . . 0.0 112.966 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 mt 68.7 -73.47 0.09 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -138.76 -77.23 0.36 Allowed 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.864 -0.523 . . . . 0.0 110.08 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m -79.73 148.78 31.38 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.853 -0.529 . . . . 0.0 110.125 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -37.38 82.89 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.099 0.476 . . . . 0.0 110.122 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -54.46 -39.62 67.64 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.682 0.753 . . . . 0.0 109.494 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -59.49 -30.07 68.3 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.038 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 3.8 tt -60.11 -38.41 82.91 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -40.52 85.19 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.23 -43.86 93.62 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.51 -36.91 77.0 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 121.694 0.759 . . . . 0.0 110.539 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.85 -35.98 69.5 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.481 -0.762 . . . . 0.0 109.846 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.58 -37.65 88.28 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.85 -0.531 . . . . 0.0 110.797 178.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 9.9 pt -69.64 -35.49 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 O-C-N 121.63 -0.669 . . . . 0.0 109.393 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 72.6 t -54.04 -46.21 65.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 4.8 t -64.02 -34.84 78.91 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.224 -0.922 . . . . 0.0 109.824 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -31.23 70.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 121.278 0.561 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . 0.415 ' CD1' HG13 ' C' ' 746' ' ' ILE . 39.3 mm -54.35 -55.37 15.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.571 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.39 -38.75 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-O 121.655 0.741 . . . . 0.0 110.875 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.88 -41.87 95.27 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.745 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.37 -43.9 69.18 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.324 0.583 . . . . 0.0 111.285 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' C' ' 747' ' ' ARG . 5.4 tp -87.37 -9.37 55.0 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.63 -38.62 82.68 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.96 109.92 19.1 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 122.286 -0.538 . . . . 0.0 110.084 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.22 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.937 0 CA-C-O 120.419 0.152 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 36.4 mt 56.04 99.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.48 0.657 . . . . 0.0 110.546 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.77 168.04 12.69 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.325 0.583 . . . . 0.0 110.236 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -43.58 -51.74 6.7 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.451 0.643 . . . . 0.0 112.232 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.9 -28.0 63.21 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -81.32 -32.27 33.15 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 122.05 -0.406 . . . . 0.0 111.496 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -68.75 -46.35 69.05 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.236 0.541 . . . . 0.0 110.38 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.04 84.64 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.992 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -26.04 67.78 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.398 0.618 . . . . 0.0 110.63 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -34.37 74.21 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.16 0.505 . . . . 0.0 110.898 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -75.59 -14.57 60.39 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 122.13 -0.356 . . . . 0.0 111.749 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.64 -33.78 75.65 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.587 0.708 . . . . 0.0 110.334 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m0 -55.99 -40.09 72.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.595 0.712 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.54 43.25 23.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.78 0.8 . . . . 0.0 111.398 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -159.69 -65.52 0.07 Allowed 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.62 -0.675 . . . . 0.0 112.016 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -38.24 80.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 121.444 0.64 . . . . 0.0 111.432 -178.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.2 m -52.94 -33.79 52.46 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -62.11 -50.05 73.46 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.817 -0.552 . . . . 0.0 111.69 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -44.23 88.07 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.431 0.634 . . . . 0.0 109.389 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.28 -35.78 81.95 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.069 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -95.93 -20.51 18.7 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.72 -19.18 29.54 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.714 -0.616 . . . . 0.0 111.648 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.479 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 7.6 pt -60.66 -36.8 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 O-C-N 121.836 -0.54 . . . . 0.0 110.321 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -55.02 -47.15 75.11 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.172 0.51 . . . . 0.0 110.036 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -67.8 -33.87 64.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . 0.479 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -60.17 -29.78 68.9 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.859 179.643 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 8.0 mm -64.42 -47.4 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.305 0.574 . . . . 0.0 109.708 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.3 mt -64.74 -39.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.92 -37.71 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.8 -40.91 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.61 -41.32 64.79 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.0 m -66.73 -38.5 86.81 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.864 0.84 . . . . 0.0 109.497 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.35 -43.7 92.77 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.171 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.5 -42.23 83.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.58 -34.14 84.75 Favored Glycine 0 CA--C 1.535 1.338 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.82 -36.93 63.04 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.322 1.058 . . . . 0.0 110.173 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -55.62 -28.59 56.1 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.8 tp -59.27 -36.59 64.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 O-C-N 121.076 -1.015 . . . . 0.0 112.083 -175.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -56.51 -30.74 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.294 -0.879 . . . . 0.0 110.439 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -58.59 -31.75 68.33 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.8 -45.45 92.29 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.93 -39.31 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.643 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.75 -37.68 87.53 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.78 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -68.37 -37.81 80.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.219 0.533 . . . . 0.0 110.596 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.39 -40.83 93.95 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.873 0.844 . . . . 0.0 108.955 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 71.6 t -67.63 -45.57 84.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.981 0.896 . . . . 0.0 108.947 178.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -63.15 -36.49 83.78 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.418 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -49.57 74.16 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.551 0.691 . . . . 0.0 111.119 -177.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 4.2 p -77.19 -41.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.599 0.714 . . . . 0.0 112.453 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.7 -40.22 63.78 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 0.1 OUTLIER -101.93 -21.34 14.55 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -175.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.08 170.93 12.78 Favored Glycine 0 N--CA 1.474 1.169 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -131.79 -53.93 1.0 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.03 -0.688 . . . . 0.0 111.86 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 51.5 p -90.35 152.26 45.39 Favored Pre-proline 0 C--O 1.232 0.144 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.748 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -35.89 98.59 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.397 2.064 . . . . 0.0 111.63 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.3 16.21 0.64 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -176.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.472 0.651 0 CA-C-O 121.794 0.807 . . . . 0.0 110.017 178.856 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 122.271 1.034 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -62.32 -26.36 68.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.958 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.03 -19.31 6.7 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.754 -0.591 . . . . 0.0 111.815 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . 0.469 ' O ' HD12 ' C' ' 746' ' ' ILE . 11.4 mtm105 -66.25 -32.84 74.5 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.246 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.55 -37.28 72.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -71.28 -36.57 71.73 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.858 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.1 p -56.82 -25.29 55.59 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.13 -0.356 . . . . 0.0 110.522 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . 0.469 HD12 ' O ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -52.79 -32.42 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.561 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . 0.42 ' HA ' HD22 ' B' ' 785' ' ' LEU . 0.7 OUTLIER -59.6 -23.3 62.85 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.265 0.555 . . . . 0.0 111.648 179.781 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 tt -72.19 -33.94 68.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.006 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.73 -54.03 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.8 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -72.47 -13.89 61.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.759 0.79 . . . . 0.0 110.012 174.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.78 -20.83 41.66 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 121.973 -0.454 . . . . 0.0 112.71 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 2.4 m -58.85 -40.99 85.93 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 117.751 0.776 . . . . 0.0 109.839 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -68.59 -48.17 64.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.608 0.718 . . . . 0.0 109.557 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.1 -35.3 73.18 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.213 0.53 . . . . 0.0 111.291 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.5 tt -59.65 -45.04 93.22 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.457 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.13 -40.69 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 109.818 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.26 -32.37 71.53 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.75 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -59.07 -39.26 81.55 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.533 -0.729 . . . . 0.0 109.124 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.41 -45.6 65.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.65 0.738 . . . . 0.0 111.509 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.41 -41.66 76.11 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.319 0.581 . . . . 0.0 112.564 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.41 -41.51 69.48 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.6 p -64.47 -45.48 87.19 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -55.0 11.84 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.683 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 764' ' ' SER . . . . . 0.449 ' O ' ' HB3' ' C' ' 765' ' ' LEU . 2.3 m -98.85 -43.46 6.74 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' C' ' 764' ' ' SER . 60.2 tp 85.71 -62.97 0.06 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.128 0.971 . . . . 0.0 110.36 -176.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.2 -74.13 0.46 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.486 -0.759 . . . . 0.0 111.887 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 68.2 m -106.58 159.47 16.16 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.734 -0.603 . . . . 0.0 111.125 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.35 -28.2 67.98 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 110.267 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -60.16 -40.6 90.48 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -30.74 69.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.286 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.3 -30.88 69.77 Favored 'General case' 0 C--N 1.344 0.366 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -39.27 73.93 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -65.51 -36.13 82.91 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.846 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.72 -37.91 77.18 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 121.489 0.662 . . . . 0.0 109.817 178.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 5.8 tp -57.45 -36.41 71.38 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.553 0.692 . . . . 0.0 109.431 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -36.14 64.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.405 0.621 . . . . 0.0 109.677 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 16.0 mt -62.07 -43.46 97.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.724 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 5.0 m -63.52 -45.92 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.917 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 1.4 p -64.11 -43.25 95.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.338 0.59 . . . . 0.0 112.109 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -32.15 72.78 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.021 -0.424 . . . . 0.0 112.075 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 79.5 mt -69.46 -43.78 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 O-C-N 121.801 -0.562 . . . . 0.0 111.607 -178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 26.8 m -56.06 -38.09 51.76 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 O-C-N 121.361 -0.837 . . . . 0.0 111.426 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -56.77 -41.88 78.41 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.435 -0.791 . . . . 0.0 111.331 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 59.7 tp -59.56 -42.62 92.81 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.046 0.45 . . . . 0.0 110.829 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.417 ' HB2' ' CZ ' ' A' ' 747' ' ' ARG . 7.9 tp -80.56 -25.76 38.4 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.207 0.527 . . . . 0.0 110.88 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -40.61 -40.03 1.97 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 111.816 -0.514 . . . . 0.0 111.816 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 115.21 13.18 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.71 0.767 . . . . 0.0 110.123 178.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.912 -1.042 . . . . 0.0 110.293 -179.7 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt 55.62 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.538 0.685 . . . . 0.0 110.341 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -175.03 169.54 3.34 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.85 -40.05 55.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -68.58 -36.28 78.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.407 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -81.13 -42.64 20.6 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.29 0.567 . . . . 0.0 110.343 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -64.34 -46.31 84.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.07 0.462 . . . . 0.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.96 76.75 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.42 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.4 m -59.72 -33.1 71.19 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.276 0.56 . . . . 0.0 110.833 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.53 -29.82 69.36 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.019 0.438 . . . . 0.0 111.092 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -60.67 -20.71 61.63 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.796 -0.565 . . . . 0.0 111.881 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -81.96 -23.99 35.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.08 0.467 . . . . 0.0 111.287 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -58.12 -43.43 87.22 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.496 0.665 . . . . 0.0 110.609 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.7 t80 56.78 37.5 28.85 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.45 0.643 . . . . 0.0 111.796 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.42 -68.23 0.08 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.633 -0.667 . . . . 0.0 112.026 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.87 -37.14 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-O 121.533 0.683 . . . . 0.0 111.532 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.1 m -51.88 -33.73 37.91 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -62.73 -49.68 74.08 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.338 0.589 . . . . 0.0 109.8 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.07 -43.96 90.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.633 0.73 . . . . 0.0 109.553 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -35.41 80.14 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.003 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -99.92 -12.47 19.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -100.61 -1.3 35.73 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.475 -0.766 . . . . 0.0 111.814 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . 0.453 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 7.9 pt -64.25 -36.75 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 O-C-N 121.918 -0.488 . . . . 0.0 110.822 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -47.28 69.84 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.376 0.608 . . . . 0.0 110.114 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.66 -26.18 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . 0.453 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -74.1 -32.4 63.2 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.038 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 20.1 mm -60.67 -48.74 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 121.153 0.501 . . . . 0.0 110.476 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 72.5 mt -67.19 -36.63 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 121.379 0.609 . . . . 0.0 109.669 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mt -58.69 -37.82 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.72 -41.38 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.03 -33.92 70.81 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 177.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -67.35 -38.29 84.59 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.886 0.85 . . . . 0.0 110.514 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.26 -42.01 90.16 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.463 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -64.95 -41.6 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.589 -0.695 . . . . 0.0 110.386 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.41 -18.36 50.2 Favored Glycine 0 CA--C 1.541 1.703 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.03 -38.24 87.9 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.789 0.804 . . . . 0.0 109.562 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . 0.423 ' HD2' ' N ' ' A' ' 696' ' ' ARG . 7.7 mpt_? -55.58 -28.71 56.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.585 0.754 . . . . 0.0 111.963 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.4 -41.59 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 O-C-N 121.472 -0.767 . . . . 0.0 109.094 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -30.25 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.251 -0.906 . . . . 0.0 110.078 177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.39 -28.65 55.4 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.588 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.1 72.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.97 -37.4 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 121.684 -0.635 . . . . 0.0 109.74 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.02 -44.02 97.6 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.128 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 2.1 p -62.69 -32.53 73.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.898 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.28 -43.82 96.83 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.385 1.088 . . . . 0.0 108.585 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.68 -41.92 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.431 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.29 -39.08 91.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.063 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -61.66 -48.68 79.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.104 0.954 . . . . 0.0 111.04 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -71.71 -44.39 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 122.29 1.043 . . . . 0.0 109.655 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -68.24 -20.57 64.82 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.871 -178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -97.11 -21.61 17.25 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.03 -1.044 . . . . 0.0 113.744 -177.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.06 69.98 0.72 Allowed Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.704 -0.622 . . . . 0.0 114.291 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 33.1 -134.73 0.03 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 97.3 p -62.81 159.33 45.75 Favored Pre-proline 0 C--N 1.353 0.752 0 O-C-N 121.166 -0.959 . . . . 0.0 112.01 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.72 105.74 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.189 0 C-N-CA 121.254 1.303 . . . . 0.0 111.504 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -101.34 -20.3 15.26 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 122.116 0.96 . . . . 0.0 109.41 -178.945 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 122.157 0.98 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -57.93 -25.33 60.76 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.536 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -6.84 0.13 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -177.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 9.9 ttm180 -59.71 -45.56 91.78 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -59.78 -32.13 70.32 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.662 0.744 . . . . 0.0 109.633 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -71.07 -46.09 62.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 121.487 -0.758 . . . . 0.0 111.075 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 97.3 p -58.27 -31.62 67.61 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.493 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.524 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.0 OUTLIER -65.93 -47.26 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 116.918 -1.515 . . . . 0.0 113.726 -179.2 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.57 ' HB3' ' CD2' ' C' ' 785' ' ' LEU . 0.0 OUTLIER -86.78 -16.66 35.62 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 122.508 2.413 . . . . 0.0 108.597 178.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 714' ' ' PRO . 0.6 OUTLIER -56.03 -18.82 10.5 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 172.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 0.4 OUTLIER -55.83 -50.37 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 174.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -71.19 -23.1 61.97 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 122.584 1.183 . . . . 0.0 107.965 172.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.19 -18.33 20.28 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.401 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.5 p -56.49 -36.26 68.93 Favored 'General case' 0 C--N 1.344 0.361 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.15 -47.85 84.29 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 176.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.18 74.08 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.7 -45.3 92.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.453 0.644 . . . . 0.0 110.492 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.9 mm -61.62 -33.18 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.31 -30.65 69.69 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.731 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.44 -43.43 75.4 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.279 -0.888 . . . . 0.0 109.654 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -70.14 -44.76 68.21 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.315 0.578 . . . . 0.0 111.034 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.83 -35.66 81.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.279 0.561 . . . . 0.0 111.737 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.56 -35.22 65.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.943 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 13.1 t -69.64 -45.58 68.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.446 0.641 . . . . 0.0 111.094 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.76 -55.16 12.17 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.91 -49.68 4.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.537 0.684 . . . . 0.0 112.771 -179.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 12.0 tp 74.18 -62.2 0.47 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -137.96 134.86 35.42 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 58.67 174.51 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.07 0.462 . . . . 0.0 110.056 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.87 -27.04 14.09 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.042 -0.411 . . . . 0.0 111.266 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -52.94 -49.59 65.73 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.586 0.708 . . . . 0.0 110.493 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -56.55 -28.01 59.08 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.279 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.62 -30.77 65.62 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.794 -0.566 . . . . 0.0 110.514 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -62.4 -31.84 72.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.521 0.676 . . . . 0.0 109.291 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.33 -47.82 84.38 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.793 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 7.6 tt -58.89 -42.13 88.83 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.548 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.16 -40.13 84.65 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.879 -0.513 . . . . 0.0 112.306 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 60.6 mt -72.03 -37.73 69.67 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.39 -36.67 73.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.71 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.24 -46.38 77.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.82 -35.44 80.61 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.763 0.792 . . . . 0.0 110.293 178.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 23.7 tpt85 -67.09 -43.39 82.69 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.8 mt -63.59 -41.13 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.312 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.44 -38.67 80.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 121.499 -0.75 . . . . 0.0 110.272 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -61.25 -49.65 76.24 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 111.092 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.14 -44.12 69.53 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.202 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.76 -17.01 61.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.862 0.363 . . . . 0.0 111.826 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -77.45 52.01 3.39 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -137.11 150.69 48.16 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 122.201 -0.588 . . . . 0.0 110.901 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.348 179.437 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 52.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.954 0.883 . . . . 0.0 111.056 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -171.43 -176.68 1.9 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.469 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.52 -43.84 68.67 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.812 0.815 . . . . 0.0 110.105 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -71.69 -31.48 66.82 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.355 -0.838 . . . . 0.0 112.537 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -44.94 21.2 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.316 0.579 . . . . 0.0 110.918 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -70.62 -42.1 71.38 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.369 0.604 . . . . 0.0 110.654 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.04 -20.92 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.33 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.0 p -65.47 -35.2 80.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.221 0.534 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.67 -31.46 69.57 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.272 0.558 . . . . 0.0 110.931 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -59.88 -24.46 64.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.096 0.474 . . . . 0.0 111.201 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -84.57 -27.72 27.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.264 0.554 . . . . 0.0 111.189 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -60.73 -53.15 60.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.482 0.658 . . . . 0.0 110.67 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.51 41.69 7.19 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.775 0.797 . . . . 0.0 111.538 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -156.68 -63.34 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.631 -0.668 . . . . 0.0 111.371 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.42 -37.33 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.803 -0.561 . . . . 0.0 111.286 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.7 m -52.36 -33.64 43.95 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.141 -0.349 . . . . 0.0 111.501 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . 0.404 ' OD1' ' CZ ' ' B' ' 681' ' ' TYR . 43.0 m-20 -62.12 -49.21 76.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.292 0.568 . . . . 0.0 110.166 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -65.62 -44.24 87.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 121.749 0.785 . . . . 0.0 109.814 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.78 -35.29 80.62 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -94.39 -34.81 12.62 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . 0.404 ' CZ ' ' OD1' ' B' ' 677' ' ' ASN . 20.7 m-30 -71.2 -20.95 62.21 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.928 -0.483 . . . . 0.0 111.77 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.5 pp -60.6 -36.43 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 121.9 -0.5 . . . . 0.0 110.224 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -54.52 -47.47 73.07 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.015 0.436 . . . . 0.0 110.875 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -69.04 -37.16 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -30.43 69.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.427 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 13.8 mm -60.62 -48.78 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 121.877 -0.515 . . . . 0.0 109.996 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 81.4 mt -61.71 -42.24 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.09 -37.74 69.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 68.5 t -56.22 -39.87 62.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.06 -27.16 68.41 Favored Glycine 0 CA--C 1.543 1.815 0 O-C-N 121.759 -0.588 . . . . 0.0 112.083 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.8 m -64.69 -45.89 84.69 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.422 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.41 -33.08 70.8 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -175.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.422 ' H ' HD11 ' B' ' 692' ' ' LEU . 0.0 OUTLIER -60.06 -41.5 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.23 -0.919 . . . . 0.0 109.278 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.2 -29.7 71.9 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.35 -37.62 81.24 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.943 0.877 . . . . 0.0 110.056 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 23.8 mmt180 -55.35 -27.42 47.18 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.206 1.188 . . . . 0.0 114.206 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 tp -58.0 -36.22 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 120.623 -1.298 . . . . 0.0 109.796 -176.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 5.0 p -66.67 -30.98 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.586 -0.696 . . . . 0.0 109.577 177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.3 m-85 -56.6 -30.59 63.41 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.52 76.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -40.81 88.63 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.3 tp -57.39 -37.97 73.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.123 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 48.0 m -64.12 -41.44 97.23 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.884 0.849 . . . . 0.0 109.885 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -43.58 98.41 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 122.162 0.982 . . . . 0.0 109.124 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.51 -40.83 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.165 -0.925 . . . . 0.0 108.878 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.69 -36.76 83.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.072 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 63.0 mtt-85 -61.94 -47.21 85.9 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 122.263 1.03 . . . . 0.0 109.931 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 3.7 t -76.95 -45.55 30.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.727 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -37.96 65.11 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.368 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -22.09 14.38 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 110.08 146.5 11.16 Favored Glycine 0 CA--C 1.53 1.006 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -89.5 -60.55 1.91 Allowed 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.09 -0.653 . . . . 0.0 112.339 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.71 159.31 85.65 Favored Pre-proline 0 CA--C 1.538 0.513 0 O-C-N 121.516 -0.74 . . . . 0.0 109.33 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . 0.424 ' HA ' HD23 ' A' ' 748' ' ' LEU . 43.3 Cg_exo -27.47 139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.931 2.421 . . . . 0.0 114.26 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 8.7 tt -106.22 -20.46 13.39 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -178.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 122.396 1.093 . . . . 0.0 111.814 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 122.095 0.95 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -57.99 -26.64 62.61 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.262 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -13.58 1.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.811 -0.556 . . . . 0.0 112.264 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 51.4 mtm-85 -66.01 -46.29 78.47 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.498 -0.751 . . . . 0.0 110.915 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -30.97 67.57 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.728 -0.607 . . . . 0.0 109.588 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -48.87 51.82 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.416 0.627 . . . . 0.0 109.716 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.3 p -58.35 -44.43 88.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 122.111 -0.368 . . . . 0.0 110.643 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.66 -20.16 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.49 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -59.43 -33.69 71.57 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.67 -16.28 15.57 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 22.3 t -55.96 -53.8 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -72.04 -24.73 61.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.067 175.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.2 -20.6 36.32 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.236 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 2.3 m -58.99 -40.6 85.34 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 121.99 -0.712 . . . . 0.0 109.238 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.9 tp -65.7 -51.15 61.62 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.401 0.62 . . . . 0.0 109.378 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.65 -35.17 75.55 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.187 0.518 . . . . 0.0 111.345 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.43 -45.23 92.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.173 0.511 . . . . 0.0 110.891 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.02 -37.64 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -68.82 -30.34 68.87 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.301 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -55.25 -49.32 72.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.346 -0.846 . . . . 0.0 110.27 -178.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.42 -41.09 73.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.723 0.773 . . . . 0.0 110.567 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -36.23 83.45 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.198 -178.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.1 -50.28 9.24 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.256 0.55 . . . . 0.0 111.775 -178.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 61.6 m -61.81 -46.09 91.02 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.825 0.821 . . . . 0.0 111.116 -178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 8.4 tt -69.02 -53.67 19.26 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.2 m -97.73 -39.43 9.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -176.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 81.8 -167.59 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -38.37 -66.88 0.23 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 9.5 t -114.82 168.96 9.44 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.606 0.717 . . . . 0.0 111.713 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.92 -17.64 62.08 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.114 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -38.94 91.94 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -67.86 -29.91 69.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.744 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.79 -34.62 73.27 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 122.023 -0.423 . . . . 0.0 109.961 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 40.6 mmm-85 -61.19 -37.95 84.81 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.94 -43.64 74.66 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.283 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 9.3 mt -66.99 -38.21 85.61 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.752 0.787 . . . . 0.0 110.584 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.91 -38.62 86.57 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.022 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.42 -41.65 60.53 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.554 -0.716 . . . . 0.0 111.567 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 2.7 pp -68.19 -37.09 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 120.524 -0.471 . . . . 0.0 110.501 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.56 -45.5 78.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.655 -0.653 . . . . 0.0 109.328 -179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 29.7 p -64.46 -42.13 96.11 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 111.395 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -31.82 72.37 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 79.3 mt -61.07 -36.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 11.4 m -54.16 -37.4 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.413 -0.805 . . . . 0.0 110.043 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -54.31 -46.32 72.77 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.528 0.68 . . . . 0.0 110.505 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.23 -44.32 84.12 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.051 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 5.1 tp -71.77 -23.91 61.66 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.183 0.516 . . . . 0.0 111.129 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.86 -41.45 20.58 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.49 128.94 33.99 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.603 0.716 . . . . 0.0 110.462 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.071 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 121.592 0.71 . . . . 0.0 109.218 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 49.3 mt 59.96 113.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.46 0.648 . . . . 0.0 110.9 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -172.88 170.44 4.55 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.881 0.848 . . . . 0.0 110.524 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.49 -53.97 49.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.466 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -72.7 -15.74 61.68 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.775 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.06 -42.57 31.85 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.141 0.496 . . . . 0.0 110.896 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -69.2 -46.14 68.17 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.461 0.648 . . . . 0.0 110.949 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.66 -27.84 66.73 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.652 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 32.8 t -63.23 -26.49 68.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.138 0.494 . . . . 0.0 111.694 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -39.75 95.09 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.093 0.473 . . . . 0.0 111.569 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -60.44 -21.17 62.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.017 0.437 . . . . 0.0 111.642 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -79.13 -29.4 43.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.358 0.599 . . . . 0.0 111.093 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -58.45 -52.18 66.71 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.592 0.71 . . . . 0.0 110.51 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.6 t80 58.54 59.9 2.77 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.173 0.987 . . . . 0.0 111.068 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -176.0 -76.26 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.138 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.42 -36.76 77.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-O 121.593 0.711 . . . . 0.0 111.947 -178.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 8.0 m -51.41 -32.43 26.33 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -55.79 -43.51 76.89 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.708 -0.62 . . . . 0.0 110.986 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.52 96.79 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.512 0.673 . . . . 0.0 109.863 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.86 81.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.015 0.436 . . . . 0.0 111.792 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -88.33 -17.87 29.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -101.45 -20.34 15.17 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.687 -0.633 . . . . 0.0 112.121 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 pp -60.5 -36.68 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 O-C-N 121.784 -0.573 . . . . 0.0 110.904 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 5.6 ttt-85 -58.22 -46.74 85.34 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.717 0.77 . . . . 0.0 109.378 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 59.1 mt -71.15 -35.18 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-O 121.391 0.615 . . . . 0.0 109.673 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.52 -31.11 69.09 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.9 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 14.0 mm -61.05 -44.2 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 75.5 mt -62.25 -37.5 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 177.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.17 -40.95 85.01 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 86.7 t -54.97 -43.83 70.88 Favored 'Isoleucine or valine' 0 C--N 1.347 0.471 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.44 -39.2 43.87 Favored Glycine 0 CA--C 1.534 1.23 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.39 -38.88 85.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.307 1.051 . . . . 0.0 109.519 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -61.01 -46.26 91.47 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -65.75 -41.57 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.388 0.613 . . . . 0.0 110.157 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.8 -35.23 89.65 Favored Glycine 0 CA--C 1.535 1.319 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.0 tt -56.11 -37.62 69.66 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.086 0.946 . . . . 0.0 110.095 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -55.83 -28.17 55.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.5 tt -58.28 -35.59 54.21 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 121.158 -0.964 . . . . 0.0 111.082 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.28 -29.68 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -56.22 -31.14 63.24 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.728 -0.607 . . . . 0.0 110.735 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.07 -37.66 77.62 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.23 -40.91 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.54 -38.34 84.13 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.536 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 43.8 p -64.17 -36.49 84.22 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.286 0.565 . . . . 0.0 110.594 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -43.29 96.8 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 122.174 0.988 . . . . 0.0 108.533 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.94 -45.05 99.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.883 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -62.71 -36.77 84.05 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.407 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . 0.41 ' HG2' ' HB3' ' C' ' 712' ' ' TYR . 0.0 OUTLIER -62.13 -50.22 72.76 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.409 -0.807 . . . . 0.0 110.333 -177.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 -44.19 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -177.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.06 -44.58 65.49 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -104.1 -22.25 13.45 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.34 173.82 16.09 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . 0.41 ' HB3' ' HG2' ' C' ' 707' ' ' ARG . 14.3 p90 -134.49 -58.37 0.83 Allowed 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.6 -0.941 . . . . 0.0 112.628 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 53.1 p -64.19 154.46 82.64 Favored Pre-proline 0 C--N 1.343 0.307 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.574 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -36.41 96.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.806 0 C-N-CA 121.933 1.755 . . . . 0.0 111.554 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.8 tp -82.83 16.85 2.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.009 0.909 . . . . 0.0 109.728 179.134 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 121.824 0.821 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -40.79 95.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.094 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.72 -38.1 77.62 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.063 0.459 . . . . 0.0 111.821 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 11.3 ttm-85 -58.3 -36.51 73.44 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.099 -0.376 . . . . 0.0 111.191 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.52 -42.98 88.95 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -71.28 -44.17 65.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.71 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -27.97 58.98 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.36 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.15 -14.64 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -25.5 64.42 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 121.315 -0.865 . . . . 0.0 108.783 178.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -24.71 31.36 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.885 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.76 -54.03 30.78 Favored 'Isoleucine or valine' 0 C--N 1.349 0.577 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -72.54 -22.81 60.96 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.746 175.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.73 36.05 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.136 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.8 t -58.78 -40.87 85.25 Favored 'General case' 0 C--O 1.234 0.237 0 O-C-N 122.031 -0.688 . . . . 0.0 109.458 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.63 -48.96 67.81 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.371 0.605 . . . . 0.0 110.254 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.22 79.94 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 111.86 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 5.4 tt -59.26 -45.16 91.95 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 110.74 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 51.1 mt -68.55 -36.36 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 121.502 0.668 . . . . 0.0 109.714 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.66 -30.36 69.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.34 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -55.44 -45.37 76.84 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.737 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -45.18 66.16 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 179.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.86 -45.96 69.69 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -67.3 -47.82 69.45 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.3 m -64.07 -45.15 90.02 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.901 0.858 . . . . 0.0 110.58 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.39 -53.31 24.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -98.23 -36.92 9.88 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.044 -1.035 . . . . 0.0 113.309 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' C' ' 766' ' ' PHE . 60.5 mt 65.0 177.68 0.19 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -177.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . 0.416 ' C ' ' O ' ' C' ' 765' ' ' LEU . 27.6 t80 -7.01 -66.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -178.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 54.7 p -130.38 172.38 11.93 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.171 0.51 . . . . 0.0 110.676 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.82 -15.73 63.77 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.792 0.33 . . . . 0.0 111.32 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -63.76 -42.16 97.86 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -64.07 -30.33 71.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.801 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.16 -32.3 70.92 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.953 -0.467 . . . . 0.0 110.015 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 17.3 ttt-85 -62.6 -38.82 91.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -67.7 -43.95 78.88 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.39 -37.47 83.54 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.71 -36.26 71.76 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.243 1.021 . . . . 0.0 108.707 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 8.6 tt -74.31 -41.33 61.33 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.704 0.764 . . . . 0.0 109.543 177.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 94.3 mt -60.91 -45.63 97.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.87 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 32.7 m -57.74 -39.19 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.57 -0.706 . . . . 0.0 111.102 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 7.2 m -63.22 -48.02 80.05 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.629 -0.67 . . . . 0.0 112.065 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -31.81 72.0 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.751 -0.593 . . . . 0.0 111.451 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.1 -40.22 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.368 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 20.3 m -53.02 -38.03 28.14 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 CA-C-N 120.185 1.357 . . . . 0.0 109.555 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -42.34 94.16 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 121.786 -0.571 . . . . 0.0 109.588 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.84 -45.01 65.29 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.57 ' CD2' ' HB3' ' A' ' 747' ' ' ARG . 17.9 tp -78.6 -18.86 53.92 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.985 -1.072 . . . . 0.0 110.441 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.26 -26.09 12.89 Favored Glycine 0 CA--C 1.54 1.643 0 N-CA-C 109.9 -1.28 . . . . 0.0 109.9 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 141.67 47.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 118.167 -0.92 . . . . 0.0 110.301 179.627 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 7.5 mp 61.57 116.34 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.469 0.652 . . . . 0.0 110.279 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -177.33 173.39 1.74 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.491 0.662 . . . . 0.0 110.086 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -51.68 -43.25 62.66 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.675 0.75 . . . . 0.0 111.118 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.31 -34.89 71.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.752 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.0 mmtt -72.03 -43.08 65.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.178 0.514 . . . . 0.0 111.301 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -67.07 -46.41 74.36 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.133 0.492 . . . . 0.0 110.596 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.44 90.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.376 0.608 . . . . 0.0 111.446 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.26 -33.25 69.18 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.248 0.547 . . . . 0.0 111.085 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.5 -25.57 68.08 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.168 -0.332 . . . . 0.0 111.799 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -61.3 -24.68 66.59 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.736 -0.603 . . . . 0.0 111.127 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -74.87 -31.38 61.6 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.334 0.588 . . . . 0.0 110.858 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 17.7 m95 -55.43 -50.46 69.74 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.683 0.754 . . . . 0.0 109.942 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 17.5 t80 58.7 12.34 2.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -124.98 -60.36 1.36 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.595 -0.691 . . . . 0.0 110.55 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -68.49 -36.66 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.485 0.66 . . . . 0.0 110.751 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.72 -33.87 36.49 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -175.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -63.7 -49.75 71.88 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.2 0.909 . . . . 0.0 110.253 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.6 t90 -65.59 -43.85 88.43 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.724 0.773 . . . . 0.0 109.525 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -35.71 81.87 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.8 t90 -101.64 -17.84 16.14 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -92.41 -8.21 45.45 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.432 -0.792 . . . . 0.0 112.053 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . 0.459 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 5.3 pt -61.06 -36.96 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.708 -0.62 . . . . 0.0 111.002 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.88 -47.44 71.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.946 0.403 . . . . 0.0 110.578 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.71 -33.45 52.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . 0.459 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.5 OUTLIER -59.81 -32.48 70.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.892 -179.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 11.0 mm -62.68 -43.25 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-O 121.526 0.679 . . . . 0.0 109.19 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 54.5 mt -66.65 -41.23 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.99 -38.27 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 78.7 t -56.99 -41.03 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.26 92.38 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -61.22 -38.9 88.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.318 1.056 . . . . 0.0 109.663 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.56 -46.1 91.46 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.791 -178.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -42.2 82.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.72 -36.54 92.87 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.8 tt -59.57 -41.88 91.2 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.835 0.826 . . . . 0.0 110.146 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -56.12 -28.55 58.3 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 49.1 mm -58.96 -35.68 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.52 -0.738 . . . . 0.0 110.831 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 4.1 p -53.98 -29.56 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 O-C-N 121.436 -0.79 . . . . 0.0 110.126 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -55.65 -30.85 61.71 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.843 -0.536 . . . . 0.0 110.41 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.72 77.44 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.21 -41.17 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.25 -36.98 76.45 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.746 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -41.66 98.28 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.358 0.599 . . . . 0.0 110.507 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.94 -40.91 95.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 122.026 0.917 . . . . 0.0 108.982 178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -68.33 -41.82 83.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.914 0.864 . . . . 0.0 108.908 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -62.72 -45.01 94.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -61.08 -39.33 89.5 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.815 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.9 -44.48 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 122.246 1.022 . . . . 0.0 108.824 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -69.56 -16.81 63.49 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.595 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -93.84 7.75 43.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.494 -0.754 . . . . 0.0 112.644 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 71.83 42.7 52.57 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 110.121 -1.191 . . . . 0.0 110.121 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.55 -167.47 0.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.117 0.961 . . . . 0.0 109.935 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 16.8 p -62.72 160.35 36.66 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.671 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -24.34 100.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 123.86 3.04 . . . . 0.0 115.608 -178.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -109.55 -20.26 12.93 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.336 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 123.068 1.414 . . . . 0.0 109.863 -178.527 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 124.244 1.973 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.38 -25.24 59.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 113.64 -1.618 . . . . 0.0 112.486 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -54.21 -30.27 49.33 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -61.12 -42.68 98.98 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.406 -0.809 . . . . 0.0 110.775 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.93 -44.34 91.33 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.799 0.809 . . . . 0.0 110.02 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -36.89 72.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 745' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 748' ' ' LEU . 42.9 p -64.58 -28.17 69.45 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.786 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.449 ' HB ' HG21 ' C' ' 781' ' ' ILE . 0.9 OUTLIER -74.0 -47.1 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.695 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 747' ' ' ARG 0.28 9.4 ttt180 -71.9 0.73 8.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.763 -178.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 745' ' ' SER . 1.1 mm? -55.71 -16.61 4.48 Favored 'General case' 0 C--N 1.375 1.691 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 168.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.313 1.4 t -53.52 -54.77 16.64 Favored 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -73.52 -28.38 61.86 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.261 174.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.15 -20.49 35.57 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.528 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 81.2 p -58.23 -37.58 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.741 0.77 . . . . 0.0 109.187 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 38.1 tp -66.75 -51.14 59.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.185 0.517 . . . . 0.0 109.748 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.62 -35.07 79.3 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.226 0.536 . . . . 0.0 112.106 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 4.7 tt -59.18 -45.36 91.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.977 0.417 . . . . 0.0 111.411 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.4 mt -65.41 -31.88 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 121.335 0.588 . . . . 0.0 109.862 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.54 -30.74 68.63 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 122.049 -0.407 . . . . 0.0 111.799 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -55.67 -46.59 77.53 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.586 -0.696 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -43.32 70.09 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.461 0.648 . . . . 0.0 110.899 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 7.2 mt -60.99 -33.36 73.11 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.253 0.549 . . . . 0.0 111.463 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -82.33 -22.15 35.72 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.4 m -75.3 -46.68 31.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 120.959 -1.088 . . . . 0.0 112.299 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.65 -53.72 17.34 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -41.49 8.2 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 1.2 tt 92.1 -64.58 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.212 1.005 . . . . 0.0 111.787 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -151.2 25.08 0.72 Allowed 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.616 -0.677 . . . . 0.0 112.732 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 18.9 p -176.34 138.33 0.31 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.596 -0.69 . . . . 0.0 110.818 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.86 -5.34 25.12 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.861 0.362 . . . . 0.0 111.46 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -82.83 -38.6 22.82 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -61.31 -30.28 70.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.258 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.98 -33.42 71.92 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.043 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -57.03 -38.06 72.62 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.28 -38.13 78.2 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.639 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -58.19 -39.57 79.28 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 121.302 0.572 . . . . 0.0 109.805 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.65 -36.2 80.12 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.547 0.689 . . . . 0.0 110.783 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -45.36 52.5 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.962 0.41 . . . . 0.0 111.161 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -37.59 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 122.046 -0.409 . . . . 0.0 110.076 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . 0.43 ' HA ' HD11 ' A' ' 781' ' ' ILE . 13.4 p -61.64 -42.87 95.87 Favored 'Isoleucine or valine' 0 C--N 1.348 0.54 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 9.1 m -64.21 -35.84 82.13 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.306 0.574 . . . . 0.0 110.33 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.67 -37.65 88.14 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . 0.43 HD11 ' HA ' ' A' ' 778' ' ' VAL . 72.8 mt -54.01 -39.71 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 121.796 -0.565 . . . . 0.0 111.342 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 6.8 m -54.76 -35.75 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 120.933 0.397 . . . . 0.0 111.041 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -53.81 -51.12 64.51 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -176.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -32.98 70.55 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 mp -84.59 -25.46 28.62 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.751 -0.593 . . . . 0.0 111.94 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.62 -45.91 89.59 Favored Glycine 0 CA--C 1.529 0.96 0 N-CA-C 109.989 -1.244 . . . . 0.0 109.989 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -88.28 145.29 25.94 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.539 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.146 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.707 0.765 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 7.9 mp 45.5 90.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.556 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.76 52.42 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 122.112 0.958 . . . . 0.0 111.409 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 13.6 tp 77.77 -46.45 0.46 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.275 1.03 . . . . 0.0 110.151 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -34.29 72.12 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.438 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.64 -41.38 27.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.825 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -75.19 -42.4 55.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.04 0.448 . . . . 0.0 111.742 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.96 -29.69 64.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.393 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.5 m -62.43 -33.79 75.49 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.084 0.468 . . . . 0.0 111.195 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -27.19 68.93 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.027 0.441 . . . . 0.0 111.588 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.0 m95 -59.79 -32.62 70.79 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.156 0.503 . . . . 0.0 111.002 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -69.6 -27.86 65.46 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.105 0.479 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -67.86 -61.5 1.84 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.513 0.673 . . . . 0.0 110.336 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 11.9 t80 63.53 24.49 14.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -132.64 -82.15 0.49 Allowed 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.446 -0.784 . . . . 0.0 111.23 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -36.04 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.417 0.627 . . . . 0.0 110.611 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.0 m -50.73 -33.13 21.75 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.02 -0.425 . . . . 0.0 110.749 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 19.7 m-20 -56.48 -49.71 73.86 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -66.06 -43.57 87.04 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.81 0.814 . . . . 0.0 109.357 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.15 -35.15 71.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -105.55 -33.74 8.0 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -70.09 -8.71 51.66 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.418 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 0.2 OUTLIER -60.33 -35.8 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.506 -0.746 . . . . 0.0 111.456 179.542 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -47.3 68.74 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 122.118 -0.364 . . . . 0.0 110.907 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -68.31 -36.21 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.418 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.6 OUTLIER -59.82 -30.8 69.18 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.246 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 13.0 mm -60.91 -47.11 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.142 0.496 . . . . 0.0 109.762 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 70.3 mt -61.21 -39.44 82.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.72 -37.57 66.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 96.9 t -56.17 -41.93 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.52 -28.21 59.35 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.2 -37.44 87.49 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.996 0.518 . . . . 0.0 110.975 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.26 -45.83 87.12 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.224 0.535 . . . . 0.0 109.997 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.34 -40.25 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 O-C-N 122.174 -0.329 . . . . 0.0 110.945 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.44 96.0 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 109.906 -1.278 . . . . 0.0 109.906 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.62 -36.49 84.41 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.411 1.1 . . . . 0.0 110.705 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -28.57 49.85 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -176.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.55 -35.57 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 120.839 -1.163 . . . . 0.0 110.092 -177.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -54.34 -30.3 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.263 -179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -56.7 -31.47 64.51 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 121.96 -0.462 . . . . 0.0 109.859 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.33 -38.38 80.19 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.02 -39.2 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tp -62.0 -36.38 81.34 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.326 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -62.1 -37.18 84.1 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 122.04 -0.413 . . . . 0.0 110.563 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -42.59 98.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 122.215 1.007 . . . . 0.0 108.349 177.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 90.4 t -64.04 -45.39 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.981 0.896 . . . . 0.0 109.05 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.81 -35.84 81.21 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.247 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.7 ttm105 -59.2 -50.47 73.89 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.822 -1.174 . . . . 0.0 110.393 -178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -78.59 -45.8 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.87 0.843 . . . . 0.0 112.66 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -74.1 -37.55 64.12 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.047 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -102.07 7.37 41.16 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 76.65 136.01 0.68 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -77.01 -49.63 14.96 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 122.233 -0.569 . . . . 0.0 110.005 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.02 157.43 33.72 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -36.31 108.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.102 1.868 . . . . 0.0 114.039 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 3.1 tp -80.11 13.93 2.09 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 27.8 p . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 -179.503 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 121.366 0.603 . . . . 0.0 111.514 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 -71.21 -26.84 63.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.897 -0.502 . . . . 0.0 111.05 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.46 -18.72 7.61 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.89 -0.506 . . . . 0.0 112.038 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -60.52 -39.68 88.66 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.917 -0.489 . . . . 0.0 111.094 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . 0.422 ' O ' ' HB ' ' B' ' 746' ' ' ILE . 1.0 OUTLIER -59.48 -34.75 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.88 -39.4 69.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.6 m -56.23 -22.79 31.72 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.577 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . 0.422 ' HB ' ' O ' ' B' ' 743' ' ' ASP . 0.6 OUTLIER -52.75 -30.53 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.163 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . 0.432 ' HA ' HD22 ' B' ' 750' ' ' ASN . 7.5 mtt180 -63.46 -14.13 47.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.418 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.13 -40.44 73.78 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -55.13 -54.12 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -176.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . 0.432 HD22 ' HA ' ' B' ' 747' ' ' ARG . 3.6 p30 -72.53 -16.11 61.77 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.439 0.638 . . . . 0.0 110.582 175.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -58.13 -21.41 46.34 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 4.4 m -64.48 -44.29 91.49 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.958 -0.731 . . . . 0.0 110.341 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.23 -45.98 71.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.056 0.932 . . . . 0.0 109.436 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.75 76.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.5 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.83 -46.3 88.0 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 121.839 -0.538 . . . . 0.0 110.956 -176.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 44.9 pt -76.2 -30.19 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 121.789 0.804 . . . . 0.0 110.575 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -69.25 -30.14 68.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.607 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.15 -49.46 77.16 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.593 -0.692 . . . . 0.0 109.148 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.37 -45.33 63.11 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.687 0.756 . . . . 0.0 111.205 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.25 -41.67 96.85 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.345 0.593 . . . . 0.0 112.279 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -82.1 -21.26 36.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 48.2 t -74.0 -45.65 48.59 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.448 -0.782 . . . . 0.0 112.151 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 5.9 mp -59.88 -54.94 40.32 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.09 -49.62 4.44 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.722 0.773 . . . . 0.0 112.53 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 72.15 120.85 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.656 0.741 . . . . 0.0 109.986 -178.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 15.1 t80 75.21 -69.19 0.18 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.322 0.649 . . . . 0.0 110.809 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 4.8 m -150.93 176.32 11.21 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.858 -0.526 . . . . 0.0 110.796 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.59 -172.31 0.16 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 78.35 -51.97 0.49 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.683 0.754 . . . . 0.0 108.985 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 15.1 tpt85 -56.62 -29.57 62.33 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.187 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -59.59 -31.99 69.97 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.937 -0.477 . . . . 0.0 109.874 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -57.18 -34.97 69.03 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.54 0.686 . . . . 0.0 109.181 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.01 -46.05 79.34 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.65 -42.69 88.96 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.524 0.678 . . . . 0.0 109.325 179.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.03 -39.0 80.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.317 0.58 . . . . 0.0 110.15 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.63 -42.6 77.82 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 122.129 -0.357 . . . . 0.0 111.276 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 52.2 mt -62.89 -41.48 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.93 -40.36 86.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.152 0.501 . . . . 0.0 110.097 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 9.8 m -62.93 -45.84 90.6 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.013 -0.429 . . . . 0.0 112.02 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.96 72.44 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.542 -0.724 . . . . 0.0 111.846 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 83.5 mt -68.54 -40.18 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.754 -0.591 . . . . 0.0 111.891 -178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 19.5 m -56.39 -38.11 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.362 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -63.25 -42.35 99.18 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.745 0.783 . . . . 0.0 109.742 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 22.8 tp -66.91 -41.57 86.9 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.8 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -35.19 80.25 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.102 0.477 . . . . 0.0 110.631 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -30.49 -51.93 0.21 Allowed Glycine 0 CA--C 1.539 1.535 0 C-N-CA 123.366 0.508 . . . . 0.0 113.04 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.59 85.87 2.44 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 122.214 1.007 . . . . 0.0 109.95 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.901 -1.047 . . . . 0.0 111.004 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 121.902 0.858 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 6.9 mp -114.59 151.53 33.29 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.322 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -175.46 174.8 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.278 0.561 . . . . 0.0 110.29 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.12 -57.1 7.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.681 0.753 . . . . 0.0 111.942 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.81 -20.7 66.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.265 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -79.18 -46.11 18.57 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.068 0.461 . . . . 0.0 110.962 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -58.5 -45.91 87.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.665 0.745 . . . . 0.0 110.288 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.83 -25.61 64.75 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.298 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 p -64.73 -35.64 81.71 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.276 0.56 . . . . 0.0 110.711 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 29.9 mt -59.91 -30.75 69.25 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.184 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.6 -25.5 64.67 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.963 -0.46 . . . . 0.0 110.857 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -77.79 -27.5 50.21 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.116 0.484 . . . . 0.0 111.277 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.34 -40.63 86.96 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.358 0.599 . . . . 0.0 110.515 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 55.63 32.43 19.23 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.299 0.571 . . . . 0.0 110.985 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -151.53 -69.12 0.17 Allowed 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.646 -0.659 . . . . 0.0 111.953 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 1.6 tp -64.91 -37.6 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 121.83 -0.544 . . . . 0.0 112.053 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.4 m -52.51 -43.12 64.89 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.864 -0.523 . . . . 0.0 111.6 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -57.66 -46.45 84.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.659 0.742 . . . . 0.0 110.13 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -65.17 -45.1 86.29 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.167 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 47.4 mt -65.75 -38.96 90.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.388 -0.82 . . . . 0.0 112.698 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -84.3 -42.04 16.22 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.891 -0.505 . . . . 0.0 112.171 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -65.81 -30.02 70.59 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.981 -0.449 . . . . 0.0 112.053 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.6 pp -62.26 -36.86 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 119.89 -0.724 . . . . 0.0 109.304 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -59.67 -45.2 92.79 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.1 mm -61.35 -42.81 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.339 1.066 . . . . 0.0 108.65 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.71 -27.4 66.41 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.031 -178.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 18.6 mm -60.27 -44.27 95.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.4 -37.74 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 38.4 mm -60.24 -39.29 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 84.5 t -55.69 -41.26 64.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -40.48 74.23 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.73 -38.23 83.25 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.824 0.821 . . . . 0.0 110.36 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.1 tp -59.42 -46.56 88.36 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.3 -41.55 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 121.747 -0.596 . . . . 0.0 109.913 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.02 -34.58 88.46 Favored Glycine 0 CA--C 1.533 1.207 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.75 -38.05 83.86 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.267 1.032 . . . . 0.0 110.214 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -56.37 -28.33 58.85 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.7 tt -58.79 -35.34 55.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 O-C-N 121.329 -0.857 . . . . 0.0 111.248 -176.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 12.9 p -53.72 -30.82 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.259 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -56.73 -31.58 64.68 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.832 -0.542 . . . . 0.0 110.27 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.94 88.63 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -68.92 -40.42 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.99 -37.56 71.82 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 40.0 m -62.39 -35.61 79.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.532 0.682 . . . . 0.0 109.436 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -41.85 99.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 122.343 1.068 . . . . 0.0 108.19 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.55 -45.36 97.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.458 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -62.79 -36.77 84.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.114 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ttm-85 -62.41 -50.45 71.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.507 -0.746 . . . . 0.0 111.645 -176.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -44.34 29.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.497 0.665 . . . . 0.0 111.714 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -74.31 -43.22 57.65 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.46 -22.06 14.13 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -174.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 135.68 -157.92 23.52 Favored Glycine 0 N--CA 1.478 1.441 0 O-C-N 121.317 -0.864 . . . . 0.0 111.675 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -147.47 -50.84 0.19 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.382 -1.069 . . . . 0.0 112.556 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 73.5 m -107.75 159.68 29.49 Favored Pre-proline 0 N--CA 1.463 0.183 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.33 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -32.97 97.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.226 1.951 . . . . 0.0 112.636 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' C' ' 716' ' ' SER . 6.1 tp -70.71 -20.0 62.7 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 716' ' ' SER . . . . . 0.496 ' C ' ' O ' ' C' ' 715' ' ' LEU . 2.3 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 122.09 0.947 . . . . 0.0 112.52 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 122.337 1.065 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -61.43 -26.4 67.84 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.934 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -21.3 13.6 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.89 -0.506 . . . . 0.0 111.808 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 31.3 mtm180 -74.28 -30.15 61.98 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.948 -0.47 . . . . 0.0 110.952 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -58.93 -44.27 91.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.564 0.697 . . . . 0.0 109.532 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -71.27 -40.37 70.99 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.213 0.53 . . . . 0.0 110.268 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 2.0 m -58.57 -41.97 86.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.843 0.354 . . . . 0.0 110.364 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 82.9 mt -58.66 -18.6 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 O-C-N 122.073 -0.392 . . . . 0.0 110.031 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -59.61 -33.3 71.3 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 5.2 tt -58.95 -18.78 36.86 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.579 179.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 93.9 t -55.69 -55.0 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -73.58 -20.19 60.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.017 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.66 -20.0 30.02 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.193 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 12.6 t -58.21 -37.85 75.62 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.69 -48.78 58.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.66 74.16 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.75 -45.55 91.88 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.346 0.593 . . . . 0.0 110.176 -178.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 42.5 mm -66.31 -36.37 77.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.44 0.638 . . . . 0.0 109.632 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.02 -34.12 74.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.03 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -56.49 -46.37 80.5 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.979 0.895 . . . . 0.0 109.16 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.4 -45.27 66.29 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.698 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -31.09 69.81 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -80.21 -49.8 11.14 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 11.6 t -65.82 -45.72 81.27 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -37.5 80.66 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 83.5 p -98.36 -49.03 4.83 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.621 0.724 . . . . 0.0 111.663 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 2.4 tt 68.4 55.85 0.5 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.454 1.121 . . . . 0.0 109.273 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 61.11 152.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.451 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.14 116.32 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.548 0.69 . . . . 0.0 111.709 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -26.63 68.84 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.734 -0.604 . . . . 0.0 110.82 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -65.52 -43.21 90.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.265 1.031 . . . . 0.0 108.293 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -64.72 -29.9 70.9 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.011 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.0 tt -59.75 -32.21 70.35 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.475 -0.766 . . . . 0.0 110.395 -178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -38.22 72.78 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.038 -0.414 . . . . 0.0 110.974 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -68.29 -33.9 75.18 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.286 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.25 -38.2 82.76 Favored 'General case' 0 C--N 1.353 0.746 0 CA-C-O 121.838 0.827 . . . . 0.0 110.113 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.17 -36.28 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.028 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -32.85 64.49 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.689 -0.632 . . . . 0.0 111.579 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 8.3 mt -64.87 -37.45 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.356 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 4.4 m -55.5 -39.72 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 122.075 -0.391 . . . . 0.0 111.751 -177.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 22.5 m -63.3 -48.21 79.04 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.774 -0.579 . . . . 0.0 110.679 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -31.56 71.98 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.486 0.66 . . . . 0.0 110.486 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.449 HG21 ' HB ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -58.2 -36.62 58.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.579 -179.268 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 39.9 t -52.74 -38.82 28.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.579 -0.701 . . . . 0.0 109.148 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.6 -41.65 86.3 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.463 -0.773 . . . . 0.0 111.197 177.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 32.8 tp -65.03 -44.58 88.67 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.467 HD21 ' HG2' ' A' ' 747' ' ' ARG . 47.2 tp -83.38 -21.8 32.95 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.432 -0.793 . . . . 0.0 110.715 -178.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -61.69 -36.89 93.36 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -104.99 136.11 45.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.621 0.725 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.533 -179.647 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 tp . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.424 0.63 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 23.5 mt 54.37 64.02 1.96 Allowed 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.643 0.735 . . . . 0.0 109.49 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . 0.44 ' C ' ' H ' ' A' ' 664' ' ' ASP . 1.5 mm-40 -157.61 73.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 2.3 tm? 70.79 -35.4 0.33 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.981 0.912 . . . . 0.0 112.742 177.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 662' ' ' GLU . 11.7 t0 -91.56 -37.16 13.28 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.006 0.431 . . . . 0.0 111.758 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -81.38 -31.44 33.3 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.149 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.46 -39.9 62.23 Favored 'General case' 0 C--N 1.34 0.193 0 O-C-N 121.955 -0.466 . . . . 0.0 111.167 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -76.91 -36.27 56.76 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 57.4 p -58.13 -30.84 66.64 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.165 0.507 . . . . 0.0 110.844 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.93 -24.1 67.6 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -64.43 -31.13 72.21 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.83 -0.544 . . . . 0.0 111.107 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -69.45 -30.1 67.94 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.309 0.576 . . . . 0.0 111.032 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -57.48 -48.98 77.77 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.503 0.668 . . . . 0.0 110.374 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 t80 53.96 32.12 14.76 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.72 0.771 . . . . 0.0 110.829 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -146.79 -68.59 0.26 Allowed 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.702 -0.624 . . . . 0.0 111.715 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -39.83 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 CA-C-O 121.418 0.628 . . . . 0.0 111.953 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 17.4 m -52.81 -33.8 50.79 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -62.55 -50.15 72.48 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.874 -0.516 . . . . 0.0 111.783 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 -65.53 -45.58 82.89 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.649 -0.657 . . . . 0.0 110.379 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.22 -35.1 78.87 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -86.29 -11.16 53.0 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.784 -0.573 . . . . 0.0 111.933 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -103.81 -21.87 13.61 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.17 -35.46 65.92 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 CA-C-N 120.729 1.604 . . . . 0.0 111.216 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 16.0 mmm-85 -52.95 -41.52 64.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.799 0.809 . . . . 0.0 109.618 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 88.4 mt -78.52 -40.91 24.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 CA-C-O 122.078 0.942 . . . . 0.0 109.305 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -27.61 68.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.442 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.75 -45.37 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.85 -37.31 71.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.99 -37.55 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.65 -42.7 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.74 -38.9 65.41 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.7 m -67.01 -38.85 86.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.697 0.76 . . . . 0.0 109.48 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -46.24 89.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.919 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -41.7 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.837 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.93 -31.25 80.18 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.03 -40.54 89.69 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.92 0.866 . . . . 0.0 110.031 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -55.53 -28.19 53.32 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.88 0.872 . . . . 0.0 112.112 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 45.3 mm -58.05 -35.33 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.52 -0.738 . . . . 0.0 109.624 -177.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 3.3 p -54.02 -28.65 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 121.784 -0.572 . . . . 0.0 110.221 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -54.55 -28.48 46.06 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.83 -0.544 . . . . 0.0 110.651 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.94 -37.42 71.49 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.4 m -67.29 -35.95 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -38.2 87.35 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.032 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 69.9 m -67.26 -40.92 86.27 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.248 0.546 . . . . 0.0 109.851 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 13.1 mt -64.91 -42.68 94.53 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-O 121.784 0.802 . . . . 0.0 109.331 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -41.49 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 2.2 m120 -60.93 -44.57 97.04 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -35.76 82.22 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.853 0.835 . . . . 0.0 110.575 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.0 t -75.59 -45.44 39.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.451 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -14.58 60.67 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . 0.419 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.8 OUTLIER -83.09 6.97 17.25 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.035 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.63 27.8 Favored Glycine 0 CA--C 1.539 1.57 0 O-C-N 122.024 -0.422 . . . . 0.0 113.17 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.6 -143.41 0.45 Allowed 'General case' 0 CA--C 1.56 1.351 0 O-C-N 121.738 -0.86 . . . . 0.0 110.435 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 81.7 p -62.12 159.7 36.32 Favored Pre-proline 0 C--N 1.351 0.667 0 O-C-N 121.293 -0.88 . . . . 0.0 110.682 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -41.57 104.56 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.585 1.523 . . . . 0.0 112.576 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -108.82 -20.57 13.02 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -177.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 121.536 0.684 . . . . 0.0 110.682 -179.442 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.311 1.053 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -57.93 -25.09 60.44 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.873 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.34 -9.86 0.33 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -175.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.65 -31.86 70.19 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.366 -0.834 . . . . 0.0 109.151 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -69.59 -45.06 69.5 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -71.11 -31.8 68.22 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.839 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 84.2 p -61.31 -42.57 98.89 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.416 ' O ' ' CG2' ' A' ' 749' ' ' VAL . 48.3 mt -57.65 -16.49 5.81 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -58.46 -25.28 62.09 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.96 -1.088 . . . . 0.0 108.87 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -14.76 21.32 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.416 ' CG2' ' O ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -54.33 -54.18 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.725 0 CA-C-N 121.4 1.909 . . . . 0.0 105.882 178.784 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -72.81 -20.43 61.14 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.074 -1.875 . . . . 0.0 110.993 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.96 38.5 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.04 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 7.2 m -61.46 -40.56 94.95 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.887 -0.772 . . . . 0.0 110.084 179.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.6 -50.87 40.4 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.56 0.695 . . . . 0.0 109.802 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.18 -34.83 78.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.176 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.5 -45.44 91.69 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.904 -0.497 . . . . 0.0 110.619 -177.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.0 mm -64.93 -34.8 72.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.725 0.774 . . . . 0.0 109.326 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -33.93 75.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.627 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -43.05 82.67 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.353 -0.842 . . . . 0.0 109.343 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -70.35 -44.33 68.38 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.664 0.745 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 12.9 mt -65.08 -32.55 74.31 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.651 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -82.39 -22.55 35.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -46.94 24.44 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.321 -0.862 . . . . 0.0 111.675 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.13 -53.4 20.38 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.514 -0.741 . . . . 0.0 111.899 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 10.0 p -97.79 -49.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.482 -0.761 . . . . 0.0 112.454 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 75.94 -7.64 1.77 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.984 0.514 . . . . 0.0 111.036 -178.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -174.95 121.42 0.22 Allowed 'General case' 0 C--N 1.347 0.493 0 O-C-N 121.346 -0.846 . . . . 0.0 110.985 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 67.1 m 48.96 -96.71 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.402 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -166.68 -21.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.243 -0.911 . . . . 0.0 112.252 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -52.43 -37.44 56.8 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.406 0.622 . . . . 0.0 110.385 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -70.31 -30.59 67.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.372 0.606 . . . . 0.0 111.029 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.61 -34.2 73.88 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.234 0.54 . . . . 0.0 109.926 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 -41.78 77.87 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -65.76 -34.48 78.27 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.24 -38.81 77.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.337 0.589 . . . . 0.0 110.489 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 6.6 tp -59.52 -36.96 77.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.235 0.54 . . . . 0.0 112.239 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.69 -42.45 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.631 -0.668 . . . . 0.0 111.634 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 29.2 pt -65.21 -35.93 76.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . 0.464 ' O ' ' HB ' ' A' ' 781' ' ' ILE . 17.5 m -54.55 -38.95 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.954 0.797 . . . . 0.0 110.171 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 17.8 p -63.07 -35.91 81.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 118.447 -1.301 . . . . 0.0 108.041 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -32.01 72.31 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.681 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . 0.464 ' HB ' ' O ' ' A' ' 778' ' ' VAL . 0.7 OUTLIER -57.54 -55.7 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.4 m -64.35 -38.89 83.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.594 0.711 . . . . 0.0 111.066 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.15 -41.64 97.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.602 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.91 -43.42 83.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.223 0.535 . . . . 0.0 111.231 -178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.0 tp -87.38 -12.91 44.9 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.966 0.412 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -63.17 -39.67 98.22 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 25.8 ptt85 -76.96 151.04 35.85 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.335 0.588 . . . . 0.0 110.809 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.468 0.459 0 CA-C-O 117.847 -1.073 . . . . 0.0 110.722 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 58.05 106.31 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.315 0.579 . . . . 0.0 110.196 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.15 177.97 4.6 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.939 0.876 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 10.1 tt -46.19 -53.76 9.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.691 0.758 . . . . 0.0 111.48 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -65.41 -29.61 70.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.578 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -76.45 -44.4 35.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.913 0.387 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -59.08 -46.1 89.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.634 0.73 . . . . 0.0 110.085 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.08 -21.64 66.61 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.228 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 4.9 m -70.35 -36.25 74.09 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.822 -0.549 . . . . 0.0 111.217 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.74 -23.82 65.24 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.992 -0.443 . . . . 0.0 111.196 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -59.86 -23.02 63.07 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.764 -0.585 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -88.14 -27.73 21.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.123 0.487 . . . . 0.0 111.265 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -57.44 -50.87 71.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.528 0.68 . . . . 0.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.64 29.94 14.99 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.136 0.494 . . . . 0.0 111.269 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -144.11 -61.47 0.39 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.671 -0.643 . . . . 0.0 111.075 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.9 tp -67.92 -37.78 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 121.323 0.582 . . . . 0.0 110.33 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.8 m -52.98 -34.55 56.56 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.758 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -69.16 -50.47 47.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.886 -0.509 . . . . 0.0 111.368 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.74 -42.17 95.4 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.0 tp -65.97 -35.74 81.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.94 0.4 . . . . 0.0 110.859 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -101.27 6.56 42.92 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.58 -21.15 9.29 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 121.71 -0.619 . . . . 0.0 110.471 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 tp -62.16 -35.53 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.771 0.796 . . . . 0.0 109.982 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -53.21 -47.36 69.0 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.622 -0.674 . . . . 0.0 109.972 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.21 -37.91 76.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 122.246 1.022 . . . . 0.0 108.394 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.73 -33.89 72.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.674 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.49 -41.98 89.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 86.2 mt -62.41 -36.95 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.15 -37.54 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.12 -38.79 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 O-C-N 121.723 -0.611 . . . . 0.0 109.447 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.64 -27.15 57.61 Favored Glycine 0 CA--C 1.546 1.995 0 O-C-N 121.902 -0.499 . . . . 0.0 112.078 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.7 m -60.77 -47.12 87.76 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -32.59 70.65 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.528 -0.733 . . . . 0.0 111.482 -178.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -57.37 -41.66 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 O-C-N 121.605 -0.684 . . . . 0.0 109.662 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.94 -32.17 83.34 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.84 -37.08 63.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.3 1.048 . . . . 0.0 109.345 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.58 -28.28 54.12 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.692 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 79.2 mt -58.77 -36.21 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 O-C-N 121.423 -0.798 . . . . 0.0 108.914 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -30.29 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 O-C-N 121.674 -0.641 . . . . 0.0 110.123 177.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -56.36 -31.01 63.38 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 121.828 -0.545 . . . . 0.0 109.871 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.89 -37.57 76.89 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.86 -40.59 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.167 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 176.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.3 tp -55.6 -37.21 67.82 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.975 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.5 m -62.37 -40.77 97.51 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.178 0.513 . . . . 0.0 110.821 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.78 -41.05 94.79 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.069 0.938 . . . . 0.0 109.265 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.68 -43.57 80.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.556 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . 0.494 ' O ' ' HB2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.77 -36.41 82.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.078 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -67.19 -47.75 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.151 -0.968 . . . . 0.0 110.375 -178.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.6 t -77.12 -46.29 28.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -73.8 -43.17 59.63 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.494 ' HB2' ' O ' ' B' ' 706' ' ' ASN . 31.5 mt-30 -102.01 -21.58 14.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -175.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 109.43 136.32 7.53 Favored Glycine 0 CA--C 1.534 1.235 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -75.4 -67.89 0.61 Allowed 'General case' 0 CA--C 1.557 1.24 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 1.7 p -65.54 159.6 66.42 Favored Pre-proline 0 N--CA 1.47 0.535 0 O-C-N 120.628 -1.295 . . . . 0.0 110.516 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -37.57 133.11 0.62 Allowed 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.996 1.798 . . . . 0.0 111.847 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.503 ' O ' ' C ' ' B' ' 716' ' ' SER . 2.0 mm? -94.16 -20.35 19.95 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.503 ' C ' ' O ' ' B' ' 715' ' ' LEU . 97.3 p . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 122.279 1.037 . . . . 0.0 112.819 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 121.47 0.653 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -71.03 -26.61 63.18 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.298 0.57 . . . . 0.0 111.284 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -56.23 -7.03 0.31 Allowed 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . 0.416 ' O ' HG13 ' B' ' 746' ' ' ILE . 3.6 ttm180 -55.73 -38.99 70.51 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.515 -0.741 . . . . 0.0 110.912 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -58.54 -43.94 89.45 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.339 0.59 . . . . 0.0 109.664 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -71.42 -39.78 70.87 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.141 0.496 . . . . 0.0 110.468 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.84 -23.76 46.32 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . 0.461 HG22 HG13 ' A' ' 781' ' ' ILE . 48.6 mt -52.43 -32.47 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.36 67.57 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.165 0.507 . . . . 0.0 110.452 179.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 45.4 mt -56.24 -35.7 67.67 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.497 0.555 . . . . 0.0 112.497 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.48 -54.11 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -72.46 -18.77 61.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.668 0.746 . . . . 0.0 110.073 175.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.4 37.26 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.377 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 83.8 p -59.21 -39.65 83.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 117.787 0.793 . . . . 0.0 110.052 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.0 tp -69.66 -51.17 37.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.8 0.81 . . . . 0.0 109.649 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.13 73.27 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.408 0.623 . . . . 0.0 111.366 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.76 -45.2 92.97 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 120.976 0.417 . . . . 0.0 110.787 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 53.7 mt -70.4 -33.7 55.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.5 0.667 . . . . 0.0 109.55 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.1 -30.28 68.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.754 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -55.61 -47.97 75.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.409 -0.807 . . . . 0.0 110.086 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -70.73 -45.25 65.22 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.1 mt -69.23 -46.28 67.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.653 0.74 . . . . 0.0 112.535 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -69.06 -40.12 78.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.682 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 15.4 t -63.92 -45.1 90.77 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.911 0.862 . . . . 0.0 110.599 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.83 -51.84 62.88 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.872 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.1 -49.23 5.07 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.878 -0.514 . . . . 0.0 111.922 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 69.45 93.54 0.08 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 122.22 1.009 . . . . 0.0 109.81 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 58.6 t80 56.54 -88.51 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.915 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.2 m -67.96 134.76 51.31 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.283 -0.886 . . . . 0.0 111.246 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.6 -33.95 69.46 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.001 0.429 . . . . 0.0 109.981 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -54.46 -38.49 66.43 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.154 0.978 . . . . 0.0 108.956 178.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.85 -29.6 60.12 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.452 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.25 -41.28 88.39 Favored 'General case' 0 C--N 1.343 0.296 0 O-C-N 121.794 -0.566 . . . . 0.0 109.841 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -59.95 -39.47 85.67 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -64.22 -45.65 87.31 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.235 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.6 -37.8 85.65 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 121.835 0.826 . . . . 0.0 110.262 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -36.65 83.92 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.646 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.67 -42.21 61.64 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.848 -0.533 . . . . 0.0 111.996 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.89 -37.44 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 121.634 -0.666 . . . . 0.0 110.468 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 13.1 p -63.32 -44.99 99.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.886 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 7.2 t -64.06 -35.72 81.67 Favored 'General case' 0 C--N 1.351 0.642 0 O-C-N 121.577 -0.702 . . . . 0.0 111.125 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -31.47 71.94 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.983 -0.448 . . . . 0.0 111.622 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 76.5 mt -67.88 -36.78 76.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 O-C-N 121.759 -0.588 . . . . 0.0 110.907 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.9 m -61.07 -39.0 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.852 -0.53 . . . . 0.0 111.984 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.4 -41.58 93.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.628 -0.67 . . . . 0.0 111.043 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.0 -42.17 99.78 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.619 0.723 . . . . 0.0 110.174 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 15.0 tp -82.36 -17.38 45.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.413 0.625 . . . . 0.0 111.624 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.37 -46.09 22.22 Favored Glycine 0 CA--C 1.531 1.074 0 O-C-N 121.797 -0.564 . . . . 0.0 112.16 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 95.5 5.29 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.488 0.661 . . . . 0.0 110.524 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.127 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.0 pp . . . . . 0 N--CA 1.496 1.827 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.0 143.28 50.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.267 0.556 . . . . 0.0 110.63 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -172.44 176.44 3.3 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.086 0.469 . . . . 0.0 110.05 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 20.7 tp -54.59 -44.0 72.64 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.767 0.794 . . . . 0.0 109.957 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.88 -33.52 76.22 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.778 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -79.19 -40.32 31.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.185 0.517 . . . . 0.0 110.736 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -70.78 -46.33 63.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 110.318 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.72 -22.26 66.59 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.442 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 36.3 t -68.1 -35.56 78.36 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.1 0.476 . . . . 0.0 111.441 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -34.47 73.35 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.117 0.484 . . . . 0.0 111.197 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 64.9 m95 -59.83 -27.93 67.04 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.117 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -77.73 -20.1 54.07 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.081 -0.387 . . . . 0.0 112.033 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -67.46 -45.07 77.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.673 0.749 . . . . 0.0 110.348 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 53.89 29.26 9.6 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.028 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.05 -75.8 0.24 Allowed 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.49 -0.756 . . . . 0.0 112.497 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -68.23 -36.67 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.62 -0.675 . . . . 0.0 111.221 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 25.3 m -51.62 -33.09 31.58 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.16 -0.337 . . . . 0.0 110.963 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -56.33 -47.89 77.85 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -43.43 92.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.87 -40.14 83.49 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -97.71 -40.39 8.6 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -69.18 -19.79 63.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.704 -0.623 . . . . 0.0 112.015 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -60.63 -36.7 72.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 1.6 ttt-85 -53.69 -45.21 70.29 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 121.861 0.839 . . . . 0.0 109.023 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.3 mm -62.38 -43.13 97.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 122.4 1.095 . . . . 0.0 108.898 177.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.47 -27.59 67.67 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.125 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.11 -46.48 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.974 -0.454 . . . . 0.0 109.889 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.02 -41.4 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -59.79 -37.59 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.951 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 79.6 t -54.78 -45.32 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.33 -38.76 62.96 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -37.93 84.65 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 122.09 0.948 . . . . 0.0 109.824 177.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.23 -46.29 88.87 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 113.166 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -61.3 -41.82 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.401 -0.812 . . . . 0.0 109.415 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.95 73.15 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.87 -37.66 66.55 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.559 -0.965 . . . . 0.0 110.196 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.91 -28.68 57.89 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 -177.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -36.85 62.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-N 121.338 1.881 . . . . 0.0 111.183 -175.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -62.55 -30.26 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.448 -0.782 . . . . 0.0 111.014 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -56.29 -31.12 63.36 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.75 -0.594 . . . . 0.0 110.04 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.18 -37.79 78.24 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -43.64 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tp -61.24 -37.71 84.06 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.209 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 61.9 m -62.52 -36.23 81.94 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.374 0.607 . . . . 0.0 110.371 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -47.01 85.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.483 1.135 . . . . 0.0 108.494 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.72 -44.26 98.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.783 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -62.57 -35.79 80.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.281 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -61.32 -50.28 73.59 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.473 -0.767 . . . . 0.0 110.655 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -77.33 -45.02 30.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.824 0.821 . . . . 0.0 111.782 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -73.83 -33.37 64.12 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -102.17 -15.49 16.65 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -177.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 91.83 133.73 6.12 Favored Glycine 0 CA--C 1.542 1.751 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -87.7 -36.72 17.23 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.764 -0.845 . . . . 0.0 113.102 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.53 149.35 35.65 Favored Pre-proline 0 N--CA 1.469 0.483 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.961 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -36.71 92.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.501 2.134 . . . . 0.0 112.704 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.97 11.03 1.94 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.492 0.663 . . . . 0.0 110.903 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -72.67 -38.31 67.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.328 0.585 . . . . 0.0 111.528 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.57 -7.49 53.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.87 -35.34 80.38 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.695 -0.628 . . . . 0.0 111.411 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -58.04 -41.19 82.74 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 109.786 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.4 68.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-O 121.214 0.531 . . . . 0.0 110.496 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 83.8 p -67.04 -43.09 83.64 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.637 -0.665 . . . . 0.0 110.178 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.43 -23.9 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.945 178.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . 0.436 ' HA ' HD22 ' C' ' 750' ' ' ASN . 6.9 mtt180 -60.01 -15.64 24.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.885 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -55.38 -31.77 62.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.972 -0.455 . . . . 0.0 110.949 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.7 t -55.73 -54.9 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . 0.436 HD22 ' HA ' ' C' ' 747' ' ' ARG . 1.1 p30 -72.39 -23.63 61.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.766 0.793 . . . . 0.0 109.761 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.75 -21.76 44.74 Favored Glycine 0 C--N 1.342 0.899 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.012 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 19.3 m -63.07 -42.24 99.62 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.943 -0.739 . . . . 0.0 109.894 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.7 tp -69.32 -44.86 70.85 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.422 0.63 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.78 -35.63 79.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.872 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.33 -45.3 95.02 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.216 0.531 . . . . 0.0 111.241 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 44.7 mm -71.67 -40.99 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.118 0.485 . . . . 0.0 110.38 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.56 -41.11 76.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -55.84 -35.89 66.92 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.346 -0.847 . . . . 0.0 110.54 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -70.37 -45.47 66.0 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.762 0.791 . . . . 0.0 111.156 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 20.8 mt -69.61 -46.07 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.676 0.75 . . . . 0.0 112.249 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.81 -27.5 65.92 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.543 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.9 m -63.96 -43.96 94.22 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.447 0.641 . . . . 0.0 111.173 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.73 -54.66 14.76 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 3.0 p -97.86 -18.26 18.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 49.67 78.86 0.09 Allowed 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.393 -0.817 . . . . 0.0 109.744 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 69.9 t80 65.9 125.0 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.234 1.016 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 23.06 88.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 178.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 22.63 -146.72 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.759 1.223 . . . . 0.0 114.028 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 74.26 -64.56 0.38 Allowed 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.201 -0.937 . . . . 0.0 109.398 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.26 69.77 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.098 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.48 -36.93 76.96 Favored 'General case' 0 C--N 1.348 0.543 0 O-C-N 121.803 -0.561 . . . . 0.0 109.731 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -42.96 82.17 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' C' ' 776' ' ' LEU . 23.6 m-20 -69.38 -34.4 74.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.556 176.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.08 -41.2 96.21 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.749 -0.594 . . . . 0.0 110.868 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.45 -38.3 83.74 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 773' ' ' ASP . 3.3 pp -74.01 -28.45 61.45 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.656 -0.652 . . . . 0.0 111.822 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.26 -39.14 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 O-C-N 121.467 -0.77 . . . . 0.0 110.682 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 12.3 m -66.36 -46.35 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.877 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 9.8 t -64.21 -37.5 87.71 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.974 -0.454 . . . . 0.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.6 72.59 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.148 -0.345 . . . . 0.0 111.567 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 8.9 tt -55.03 -39.95 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.546 -0.721 . . . . 0.0 111.233 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 20.3 m -60.16 -38.29 76.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.276 -0.569 . . . . 0.0 111.917 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -64.51 -45.21 88.21 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.708 -0.62 . . . . 0.0 111.531 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.29 -36.52 74.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.653 0.74 . . . . 0.0 109.997 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.64 -36.88 85.68 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.201 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.61 -34.0 9.53 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -102.27 151.91 21.67 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 122.116 -0.637 . . . . 0.0 110.209 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.254 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.5 tp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.755 0.788 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 76.0 mt 52.75 81.03 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.046 0.927 . . . . 0.0 111.209 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.75 177.82 8.44 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -34.38 61.22 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.253 0.549 . . . . 0.0 110.15 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -75.79 -35.54 60.04 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -80.1 -41.2 26.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.259 0.552 . . . . 0.0 110.676 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -67.96 -43.62 78.62 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.298 0.57 . . . . 0.0 110.281 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.54 -29.52 63.65 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.722 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 36.7 t -69.77 -30.56 68.16 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 110.745 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 17.8 tp -61.02 -31.5 71.13 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.843 0.354 . . . . 0.0 111.173 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.58 -18.3 39.98 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.921 -0.487 . . . . 0.0 111.702 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -84.02 -16.08 45.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.921 -0.487 . . . . 0.0 111.807 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.6 -50.22 74.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.341 0.591 . . . . 0.0 110.88 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 55.3 t80 56.55 44.42 24.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.005 0.907 . . . . 0.0 110.982 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -153.59 -80.61 0.09 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.8 -0.562 . . . . 0.0 110.561 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 11.2 tt -68.13 -35.71 72.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.841 -0.537 . . . . 0.0 111.973 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -50.22 -33.34 19.13 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -174.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -63.26 -50.42 70.23 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.331 0.969 . . . . 0.0 109.001 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . 0.411 ' CD1' ' C ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -66.07 -44.37 84.72 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.577 0.704 . . . . 0.0 110.123 177.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.67 -37.08 86.0 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -92.11 -44.51 8.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -73.38 -0.82 15.89 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -36.37 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 121.296 -0.878 . . . . 0.0 109.622 178.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.77 -47.58 70.57 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.96 0.41 . . . . 0.0 110.874 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.43 -31.98 53.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -33.61 76.19 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 8.9 mm -60.83 -49.51 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 109.991 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.0 mt -61.48 -38.5 80.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.09 -37.16 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.245 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 74.9 t -54.2 -39.65 43.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.7 -41.73 97.6 Favored Glycine 0 CA--C 1.534 1.24 0 N-CA-C 108.961 -1.655 . . . . 0.0 108.961 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -61.77 -37.9 86.04 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.777 0.798 . . . . 0.0 109.766 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.88 -46.09 88.65 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.879 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -40.1 81.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.538 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -26.73 64.07 Favored Glycine 0 CA--C 1.54 1.652 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.41 -37.33 85.39 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.691 1.234 . . . . 0.0 109.332 177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -55.9 -28.31 56.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.019 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -37.12 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.03 -1.043 . . . . 0.0 109.869 -177.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.1 p -67.41 -30.57 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 121.547 -0.721 . . . . 0.0 109.952 177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -28.79 56.94 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.232 0.539 . . . . 0.0 109.713 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.06 72.01 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.9 m -61.01 -35.93 68.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -38.0 72.81 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.0 m -64.18 -36.7 84.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.748 0.785 . . . . 0.0 109.707 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -44.11 97.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 122.495 1.14 . . . . 0.0 108.636 178.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.45 -42.03 92.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.484 178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -62.61 -37.08 84.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.574 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 21.4 ttm105 -61.59 -46.93 87.77 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.096 0.951 . . . . 0.0 110.334 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.3 t -75.77 -44.04 39.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.15 0.976 . . . . 0.0 109.833 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.88 -14.89 61.58 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -20.69 18.2 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.297 -0.877 . . . . 0.0 111.962 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.9 24.96 7.03 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . 0.416 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 59.07 -103.55 0.17 Allowed 'General case' 0 CA--C 1.562 1.406 0 O-C-N 121.956 -0.732 . . . . 0.0 111.559 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 713' ' ' SER . . . . . 0.416 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 2.2 p -79.39 159.52 72.2 Favored Pre-proline 0 C--N 1.349 0.558 0 O-C-N 120.931 -1.106 . . . . 0.0 110.013 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -41.72 110.82 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.574 1.516 . . . . 0.0 112.514 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.94 -18.97 13.56 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 122.072 -0.392 . . . . 0.0 111.797 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.546 0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 111.044 -179.802 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.77 0.795 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -26.52 62.38 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.69 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -13.48 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -73.79 -46.82 43.08 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.358 -0.839 . . . . 0.0 110.148 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . 0.421 ' HA ' HG23 ' C' ' 781' ' ' ILE . 1.3 p30 -62.79 -34.68 77.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 122.52 1.152 . . . . 0.0 109.645 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -37.87 70.34 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.645 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.3 t -70.02 -39.7 75.65 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.626 -0.671 . . . . 0.0 112.654 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.484 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.0 OUTLIER -66.36 -41.26 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-O 116.367 -1.778 . . . . 0.0 115.28 -176.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.457 ' HB2' ' HB3' ' C' ' 785' ' ' LEU . 1.6 tmt_? -78.37 -11.51 59.95 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 123.568 2.895 . . . . 0.0 109.212 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -55.78 -20.54 15.32 Favored 'General case' 0 C--N 1.375 1.698 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 172.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.484 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.8 p -54.67 -50.41 60.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 177.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.405 ' HB2' ' HD3' ' A' ' 747' ' ' ARG . 1.3 m-80 -71.99 -28.17 63.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.4 -18.65 22.92 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.409 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 77.6 p -56.63 -36.77 69.85 Favored 'General case' 0 C--N 1.347 0.458 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 33.7 tp -61.53 -47.96 83.19 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.74 -34.59 71.54 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.768 178.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.01 -44.68 91.72 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.725 -0.61 . . . . 0.0 111.38 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.36 -32.63 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.43 -30.67 68.65 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.019 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.433 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 4.4 m-20 -58.02 -46.99 84.4 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.94 0.876 . . . . 0.0 108.814 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.71 -42.24 70.86 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.505 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 19.3 mt -68.25 -33.39 74.3 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -70.65 -27.43 64.03 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 2.8 m -75.82 -45.35 36.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.544 0.688 . . . . 0.0 110.819 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.5 -56.79 7.16 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.41 -49.53 4.21 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.085 0.945 . . . . 0.0 112.301 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 2.9 tm? 91.32 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.354 1.462 . . . . 0.0 110.626 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -114.11 -68.07 0.95 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.648 -0.657 . . . . 0.0 111.266 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 24.8 p -91.45 158.8 16.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -78.31 -18.26 55.46 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.122 0.487 . . . . 0.0 111.015 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -72.36 -35.3 68.48 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.589 0.709 . . . . 0.0 109.345 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -57.85 -30.02 65.45 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.243 0.544 . . . . 0.0 110.68 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -34.82 73.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -56.84 -37.58 71.47 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.599 0.714 . . . . 0.0 109.582 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.31 -48.58 72.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.83 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.52 -38.48 84.53 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.653 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.59 -36.97 74.83 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.4 -0.813 . . . . 0.0 110.641 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.23 -45.31 48.91 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.99 -0.444 . . . . 0.0 112.069 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.31 -37.25 79.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.685 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 38.5 t -56.28 -46.79 81.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 68.2 p -64.13 -35.37 80.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.606 0.717 . . . . 0.0 109.854 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -65.3 -38.4 90.08 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.129 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 78.4 mt -59.29 -37.07 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 O-C-N 122.078 -0.389 . . . . 0.0 111.399 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 5.7 m -54.39 -38.34 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 121.331 -0.856 . . . . 0.0 110.431 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -64.57 -42.51 95.61 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.399 0.619 . . . . 0.0 110.768 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.22 -43.94 69.63 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.399 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -21.86 63.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.861 -0.525 . . . . 0.0 111.057 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -43.4 -28.2 0.9 Allowed Glycine 0 CA--C 1.538 1.482 0 O-C-N 122.13 -0.356 . . . . 0.0 112.237 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 152.17 24.71 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.022 -0.693 . . . . 0.0 110.779 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 118.027 -0.987 . . . . 0.0 111.488 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.4 mm? 60.25 110.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.342 0.591 . . . . 0.0 110.239 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -177.2 169.4 2.29 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.21 -38.6 53.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.402 0.62 . . . . 0.0 110.552 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -70.96 -37.16 72.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.336 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -70.31 -47.85 59.3 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.364 0.602 . . . . 0.0 110.775 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -60.22 -45.4 93.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.435 0.636 . . . . 0.0 110.182 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.8 -25.68 65.71 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.311 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.29 -37.75 88.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.216 0.531 . . . . 0.0 111.136 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 45.0 mt -60.13 -30.28 69.18 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.015 0.436 . . . . 0.0 111.718 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -59.56 -25.15 64.31 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.211 0.529 . . . . 0.0 110.695 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -81.14 -22.03 39.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.091 0.472 . . . . 0.0 111.328 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -70.01 -49.69 48.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.649 0.737 . . . . 0.0 110.702 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.6 t80 59.78 49.69 7.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.02 0.914 . . . . 0.0 111.031 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -158.21 -70.37 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.867 -0.52 . . . . 0.0 110.855 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.19 -37.18 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.129 0.49 . . . . 0.0 110.912 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.34 -33.74 44.13 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -65.28 -50.86 64.13 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 121.495 -0.753 . . . . 0.0 110.753 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -65.84 -44.03 86.75 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.854 0.835 . . . . 0.0 109.094 177.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.65 -35.73 81.5 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.25 -28.1 12.83 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -82.6 -6.04 59.13 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.432 -0.792 . . . . 0.0 112.155 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.462 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 3.3 pt -60.88 -36.74 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.782 -0.574 . . . . 0.0 111.038 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.39 -47.08 69.82 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.075 0.464 . . . . 0.0 110.291 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.99 -34.0 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.462 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.4 OUTLIER -60.56 -27.62 67.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.38 179.606 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 22.4 mm -60.75 -45.53 97.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.256 0.55 . . . . 0.0 109.537 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 71.6 mt -62.63 -40.87 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.6 mt -58.61 -37.53 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 62.8 t -57.77 -43.35 83.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.63 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.71 -26.71 47.4 Favored Glycine 0 CA--C 1.544 1.845 0 O-C-N 121.579 -0.701 . . . . 0.0 111.926 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 18.6 m -60.52 -45.82 92.41 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -32.61 70.58 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 119.674 1.124 . . . . 0.0 111.586 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.42 -44.98 85.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.579 -0.701 . . . . 0.0 109.628 -178.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.09 67.66 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.17 -37.4 80.04 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.018 0.913 . . . . 0.0 110.424 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.46 ' HD2' ' N ' ' B' ' 696' ' ' ARG . 8.4 mpt_? -54.85 -28.48 50.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.077 0.951 . . . . 0.0 113.259 -178.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -36.4 62.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 O-C-N 120.953 -1.092 . . . . 0.0 109.204 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -30.22 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 121.499 -0.751 . . . . 0.0 110.413 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.29 -31.09 63.33 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 121.861 -0.524 . . . . 0.0 109.861 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.67 77.23 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -42.15 89.63 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 176.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.3 tp -58.64 -38.76 78.8 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.423 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -62.92 -35.17 79.21 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.375 0.607 . . . . 0.0 110.414 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -42.32 95.0 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 122.191 0.996 . . . . 0.0 108.965 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 72.0 t -66.77 -45.17 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 122.192 0.996 . . . . 0.0 108.783 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.4 m-80 -62.86 -36.43 83.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -69.0 -50.13 51.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.741 0.781 . . . . 0.0 111.151 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . 0.524 HG22 ' HA ' ' C' ' 713' ' ' SER . 1.0 OUTLIER -77.95 -44.67 28.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.148 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -59.75 -45.69 91.43 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' B' ' 706' ' ' ASN . 3.8 pt20 -105.08 -24.11 12.83 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 140.41 164.96 10.11 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -98.5 -65.49 0.96 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.899 -0.765 . . . . 0.0 111.511 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 38.6 p -72.56 159.47 85.28 Favored Pre-proline 0 CA--C 1.532 0.282 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.299 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -34.59 125.02 0.19 Allowed 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.269 1.979 . . . . 0.0 113.352 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' B' ' 716' ' ' SER . 7.2 tt -87.5 -20.4 26.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.42 ' C ' ' O ' ' B' ' 715' ' ' LEU . 27.2 t . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 122.131 0.967 . . . . 0.0 113.175 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.16 0.981 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -57.93 -26.33 62.1 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.401 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.4 -8.67 0.36 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 4.8 ptt-85 -78.18 -26.65 47.73 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.296 -0.877 . . . . 0.0 111.453 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -58.14 -45.89 86.6 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.97 -0.456 . . . . 0.0 110.095 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.97 -34.76 69.22 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.245 0.545 . . . . 0.0 109.991 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -56.79 -33.7 66.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.357 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -55.63 -17.95 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.37 177.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -58.81 -25.81 63.52 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 4.4 pp -55.43 -23.29 24.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.009 0.433 . . . . 0.0 110.593 178.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 74.7 t -55.41 -53.93 30.62 Favored 'Isoleucine or valine' 0 C--N 1.348 0.537 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.22 -20.11 61.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.355 176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.45 -20.52 37.91 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 16.3 m -59.04 -41.83 88.8 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 121.871 -0.782 . . . . 0.0 109.804 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -65.78 -50.5 64.48 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.552 0.692 . . . . 0.0 110.09 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.41 -35.4 79.1 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.188 0.518 . . . . 0.0 111.641 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 7.1 tt -59.6 -45.3 92.32 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.909 -0.495 . . . . 0.0 110.857 -178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 60.0 mt -63.61 -36.56 76.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.808 0.813 . . . . 0.0 108.857 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -30.28 69.13 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.584 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 95.6 m-20 -55.34 -49.4 72.33 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.715 0.769 . . . . 0.0 109.817 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -70.53 -44.69 67.01 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.0 -29.68 70.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -82.05 -45.47 15.23 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -42.68 65.13 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.683 0.754 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.83 -53.84 52.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.488 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.4 p -97.89 -49.48 4.78 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.427 0.632 . . . . 0.0 112.112 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.0 tt 64.9 104.86 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.995 0.902 . . . . 0.0 111.711 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.41 -76.06 0.06 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.84 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 13.3 m -112.78 172.14 7.11 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.429 -0.794 . . . . 0.0 112.071 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -37.54 30.17 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.116 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -53.08 -38.99 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.275 1.036 . . . . 0.0 109.027 178.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 18.7 tpt85 -61.13 -29.76 69.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.007 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.75 -33.08 71.2 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.854 -0.529 . . . . 0.0 110.537 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -56.66 -32.89 65.82 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -47.67 85.32 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.723 0.773 . . . . 0.0 110.142 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.68 -43.07 99.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.085 0.469 . . . . 0.0 111.046 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 65.2 mt -74.01 -41.15 62.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 1.9 pp -70.26 -37.22 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 121.765 -0.585 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 40.7 t -61.25 -46.08 97.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.503 -0.748 . . . . 0.0 109.786 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 5.0 t -63.77 -41.99 97.87 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 121.766 -0.583 . . . . 0.0 112.085 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -31.86 72.12 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.84 -0.537 . . . . 0.0 111.756 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.73 -36.47 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 122.03 -0.419 . . . . 0.0 110.754 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 8.9 m -54.06 -38.26 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.572 -0.705 . . . . 0.0 109.908 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -61.22 -41.86 97.6 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.561 0.696 . . . . 0.0 110.425 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.14 -44.06 80.78 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.708 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 27.9 tp -82.88 -13.96 55.15 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.293 0.568 . . . . 0.0 111.351 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.99 -42.41 60.66 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.98 133.19 41.98 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.607 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.43 0.633 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -113.13 152.6 29.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.344 0.592 . . . . 0.0 109.581 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -167.61 158.11 10.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.319 0.58 . . . . 0.0 109.719 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -53.62 47.88 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 122.135 0.969 . . . . 0.0 109.62 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -66.76 -18.53 65.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.062 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -81.12 -48.44 12.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.062 0.458 . . . . 0.0 110.495 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -56.6 -46.42 80.88 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.28 0.562 . . . . 0.0 110.338 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.11 -25.67 67.11 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.325 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -35.64 81.54 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 122.077 -0.389 . . . . 0.0 111.463 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.5 -35.92 77.09 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.224 0.535 . . . . 0.0 111.424 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -59.91 -26.74 66.16 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.129 0.49 . . . . 0.0 110.826 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -74.09 -34.38 63.96 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.233 0.54 . . . . 0.0 110.975 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -53.83 -43.64 69.59 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.487 0.66 . . . . 0.0 110.552 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 55.89 41.34 30.12 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.404 0.621 . . . . 0.0 111.165 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -156.67 -72.63 0.1 Allowed 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.724 -0.61 . . . . 0.0 112.18 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.19 -37.6 78.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-O 121.508 0.67 . . . . 0.0 111.684 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.18 -33.65 41.59 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.987 -0.446 . . . . 0.0 112.163 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -56.97 -49.52 75.46 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.592 0.711 . . . . 0.0 110.205 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -65.22 -40.79 94.59 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.193 0.52 . . . . 0.0 109.788 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 13.7 mt -66.07 -38.25 87.82 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -96.02 -18.48 20.19 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.42 -16.06 31.77 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.644 -0.66 . . . . 0.0 111.809 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.471 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 6.3 pt -62.93 -37.02 78.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.785 -0.572 . . . . 0.0 111.439 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -53.79 -47.38 70.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.611 0.719 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.92 -36.52 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . 0.471 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.74 -32.09 70.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.376 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 9.4 mm -61.16 -47.78 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.168 0.509 . . . . 0.0 109.856 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.4 mt -62.48 -39.86 85.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.206 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.86 -36.83 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 75.8 t -53.98 -40.05 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.8 -41.15 90.66 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.2 m -64.44 -37.8 88.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.656 0.741 . . . . 0.0 109.488 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -59.52 -43.54 93.38 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.262 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -41.9 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 122.114 -0.366 . . . . 0.0 110.975 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.67 -26.65 65.15 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.47 -40.33 85.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.882 0.849 . . . . 0.0 110.376 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -55.65 -28.98 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.7 tt -59.31 -35.63 59.23 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.501 -0.75 . . . . 0.0 111.416 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 8.9 p -54.1 -29.82 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -55.9 -31.32 62.75 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.793 -0.567 . . . . 0.0 110.303 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.45 81.28 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.08 -41.89 81.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.91 -37.34 79.16 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.568 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 73.5 m -62.64 -39.31 93.44 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.989 0.423 . . . . 0.0 110.765 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -40.91 96.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.868 0.842 . . . . 0.0 108.857 178.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.04 -44.69 99.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -62.23 -35.64 79.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.593 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . 0.416 ' CZ ' ' CD1' ' A' ' 712' ' ' TYR . 2.5 tmm_? -60.07 -50.92 71.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.907 0.86 . . . . 0.0 111.078 -177.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.72 -44.3 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.813 0.816 . . . . 0.0 111.167 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -72.97 -34.71 66.65 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.405 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 8.3 tt0 -102.82 -20.89 14.14 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 115.58 -177.27 17.07 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -128.25 -50.96 1.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 713' ' ' SER . . . . . 0.524 ' HA ' HG22 ' B' ' 708' ' ' VAL . 31.6 p -106.78 159.48 29.74 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.356 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -34.06 94.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 122.424 2.082 . . . . 0.0 112.869 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 18.8 tp -81.03 -1.88 45.76 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.958 0.885 . . . . 0.0 113.315 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.797 0.808 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 tpt85 -59.03 -30.5 68.07 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.254 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -56.43 -13.38 2.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 16.8 mtm-85 -75.57 -44.84 41.12 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.565 -0.709 . . . . 0.0 111.468 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.35 -44.36 88.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.188 0.518 . . . . 0.0 109.991 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -36.04 71.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.041 0.448 . . . . 0.0 110.327 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -57.56 -42.86 83.87 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.908 -0.495 . . . . 0.0 110.274 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.96 -19.74 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.635 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -59.44 -34.26 72.29 Favored 'General case' 0 C--N 1.343 0.285 0 O-C-N 121.071 -1.018 . . . . 0.0 109.26 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 9.6 tt -57.35 -17.64 13.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.84 -53.35 38.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -71.89 -18.68 62.03 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.558 0.694 . . . . 0.0 109.568 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.27 -20.58 36.8 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.9 p -58.31 -37.9 75.99 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -69.22 -50.34 48.22 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.653 0.74 . . . . 0.0 109.232 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.09 -34.64 72.22 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.935 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.71 -45.47 89.48 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.908 -0.495 . . . . 0.0 111.067 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 74.2 mt -68.26 -41.78 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.771 0.796 . . . . 0.0 108.981 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -67.1 -30.68 70.77 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.74 -45.67 92.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.224 -0.923 . . . . 0.0 108.608 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -42.27 72.69 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.595 0.712 . . . . 0.0 110.975 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -42.64 76.63 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -74.57 -49.44 21.78 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.062 0.458 . . . . 0.0 111.841 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.6 t -59.77 -45.85 91.0 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.478 -0.764 . . . . 0.0 110.18 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.2 tt -68.84 -54.15 17.34 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -99.19 -49.63 4.42 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.826 0.822 . . . . 0.0 112.785 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 77.41 -179.53 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.474 0.709 . . . . 0.0 109.368 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.99 138.09 6.84 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.476 0.655 . . . . 0.0 111.156 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 m 57.94 165.07 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.5 0.667 . . . . 0.0 111.065 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.32 0.65 43.38 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.402 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -81.62 -44.76 16.76 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 -64.15 -28.36 69.71 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.561 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.18 -30.1 66.16 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -56.61 -32.88 65.72 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -65.27 -47.32 77.12 Favored 'General case' 0 C--N 1.352 0.693 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.2 -37.6 77.86 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.603 0.716 . . . . 0.0 110.319 178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.68 -36.35 71.82 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.652 0.739 . . . . 0.0 109.909 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.89 -40.42 60.93 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.507 -0.746 . . . . 0.0 110.361 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 41.9 mt -62.88 -37.37 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 O-C-N 122.252 -0.28 . . . . 0.0 111.618 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 29.6 m -55.44 -39.59 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.281 -178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.7 m -63.47 -40.67 97.72 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-O 121.971 0.891 . . . . 0.0 109.584 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.81 -38.42 86.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.657 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.421 HG23 ' HA ' ' A' ' 743' ' ' ASP . 63.9 mt -60.56 -42.22 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.8 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 48.6 t -53.7 -38.33 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.631 -178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.34 -45.12 89.2 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.93 -0.481 . . . . 0.0 111.358 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.64 -45.1 65.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.457 ' HB3' ' HB2' ' A' ' 747' ' ' ARG . 11.8 tp -87.82 -13.98 40.76 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 121.011 -1.056 . . . . 0.0 110.599 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.89 -25.48 16.27 Favored Glycine 0 CA--C 1.538 1.485 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.7 136.31 52.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.859 -1.067 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.5 tp . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 47.3 mt 58.13 104.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.772 0.796 . . . . 0.0 110.834 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -174.65 -171.51 0.57 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.69 -41.22 63.67 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.564 -0.71 . . . . 0.0 110.635 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.5 -32.24 66.02 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -77.48 -44.93 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.435 0.636 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -70.46 -44.64 67.33 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.3 0.571 . . . . 0.0 110.847 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.79 65.82 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.524 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 46.3 t -66.92 -34.94 78.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.208 0.528 . . . . 0.0 111.271 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -35.22 74.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.376 0.608 . . . . 0.0 111.079 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.88 -22.79 62.82 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.203 0.525 . . . . 0.0 111.242 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -79.86 -20.81 45.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.247 0.546 . . . . 0.0 111.264 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -71.55 -49.79 37.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.598 0.713 . . . . 0.0 110.456 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 39.3 t80 62.15 39.38 12.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.832 0.825 . . . . 0.0 111.118 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -152.77 -68.3 0.16 Allowed 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.83 -0.544 . . . . 0.0 110.94 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.07 -36.95 77.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.096 -0.377 . . . . 0.0 111.213 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -51.81 -34.35 39.71 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.84 -50.1 67.99 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 121.685 -0.634 . . . . 0.0 110.32 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 4.4 t90 -65.69 -44.01 87.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.79 0.805 . . . . 0.0 109.695 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -35.72 81.33 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -96.13 -43.72 7.62 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -68.21 -6.66 24.72 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.693 -0.629 . . . . 0.0 112.552 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.7 pp -60.63 -36.43 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 121.626 -0.671 . . . . 0.0 110.403 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 9.9 ttt-85 -57.06 -47.27 81.38 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.046 0.45 . . . . 0.0 110.606 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -67.74 -34.13 65.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -31.33 69.72 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.041 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 14.5 mm -60.7 -49.31 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.117 0.484 . . . . 0.0 109.824 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.79 -40.39 84.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.99 -36.77 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.86 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -54.16 -39.83 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.4 -37.09 91.5 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.4 m -64.87 -38.29 90.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.759 0.79 . . . . 0.0 109.602 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -40.8 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.339 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.81 -23.41 61.15 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.63 -38.28 87.09 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.03 0.919 . . . . 0.0 109.506 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.5 mmt180 -55.92 -28.0 54.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.286 1.034 . . . . 0.0 112.767 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 mm -58.7 -37.44 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 O-C-N 121.077 -1.014 . . . . 0.0 108.339 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.5 p -67.72 -30.74 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 121.481 -0.762 . . . . 0.0 109.887 176.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.5 m-85 -55.88 -28.68 57.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 110.442 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.04 71.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 4.8 m -64.49 -36.0 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.669 -0.644 . . . . 0.0 110.043 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.2 tp -57.7 -40.05 78.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 122.028 -0.42 . . . . 0.0 111.016 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.6 m -62.78 -37.41 86.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.534 0.683 . . . . 0.0 110.499 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -42.0 96.7 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 122.089 0.947 . . . . 0.0 108.702 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.18 -43.74 95.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.981 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.22 -42.89 99.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.356 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -60.99 -43.79 98.36 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.411 0.624 . . . . 0.0 110.697 -178.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.4 -43.47 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.178 0.989 . . . . 0.0 109.179 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.13 -15.04 61.49 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -22.3 14.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.62 1.554 . . . . 0.0 113.268 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.98 14.07 1.89 Allowed Glycine 0 CA--C 1.537 1.422 0 O-C-N 121.376 -0.828 . . . . 0.0 113.544 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.33 -127.62 0.83 Allowed 'General case' 0 CA--C 1.571 1.775 0 O-C-N 121.556 -0.967 . . . . 0.0 110.466 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 89.3 p -62.08 159.9 34.41 Favored Pre-proline 0 C--N 1.353 0.72 0 O-C-N 120.669 -1.27 . . . . 0.0 110.782 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -35.12 110.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.301 2.0 . . . . 0.0 112.593 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.04 -20.73 12.92 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 122.56 1.172 . . . . 0.0 111.798 -179.622 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 121.683 0.754 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -58.02 -26.47 62.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.595 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -9.23 0.42 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 8.1 mtm-85 -62.89 -46.53 87.38 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.369 -0.832 . . . . 0.0 111.142 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 44.4 p-10 -65.84 -38.68 89.51 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.283 0.563 . . . . 0.0 111.871 -178.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -71.44 -38.01 71.39 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 121.163 -0.96 . . . . 0.0 109.845 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 20.6 p -66.25 -45.96 78.77 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.948 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.422 ' HB ' HG23 ' C' ' 781' ' ' ILE . 1.4 mp -63.12 -46.74 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-O 117.89 -1.053 . . . . 0.0 111.262 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.559 ' HD3' ' HB3' ' C' ' 785' ' ' LEU 0.321 0.1 OUTLIER -69.93 -0.06 6.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 115.822 -2.351 . . . . 0.0 111.614 -177.624 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.23 -15.65 6.41 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 169.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.425 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.314 2.0 t -53.4 -54.64 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 175.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.407 ' H ' HD21 ' A' ' 750' ' ' ASN . 1.3 m-80 -73.25 -27.21 61.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.48 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.8 -19.3 28.35 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.697 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 52.2 p -57.27 -37.23 72.07 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.91 -49.45 76.15 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.29 72.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.646 178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.15 -43.24 92.04 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.706 -0.621 . . . . 0.0 111.899 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -33.66 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -69.43 -30.63 68.6 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.947 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.472 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 5.7 m-20 -56.07 -48.44 76.07 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.985 0.898 . . . . 0.0 108.955 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.39 -44.3 68.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.509 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 30.1 mt -67.37 -35.0 78.46 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 32.4 mtm180 -79.73 -19.51 48.63 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 68.6 p -77.36 -46.39 22.99 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.34 -0.85 . . . . 0.0 111.27 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 2.8 mp -68.89 -53.97 18.16 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 53.8 p -98.45 -48.95 4.83 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.221 -0.924 . . . . 0.0 111.939 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.8 tp 89.22 -82.97 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.675 1.19 . . . . 0.0 110.263 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -106.05 -65.42 1.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.572 -0.705 . . . . 0.0 110.756 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.6 m -103.05 144.44 31.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.117 0.484 . . . . 0.0 110.596 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -62.41 -26.74 68.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.085 0.469 . . . . 0.0 110.373 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -52.98 -39.06 62.73 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.599 0.714 . . . . 0.0 109.885 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.4 tpt85 -63.35 -30.62 71.72 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.662 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.42 -38.24 83.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.165 0.507 . . . . 0.0 110.481 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 58.0 ttp180 -59.03 -42.16 89.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.648 0.737 . . . . 0.0 109.207 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -69.05 -43.42 74.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.821 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.416 ' O ' HG13 ' A' ' 777' ' ' ILE . 0.7 OUTLIER -62.16 -37.7 86.19 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 121.53 0.681 . . . . 0.0 111.46 -179.317 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.39 -36.92 83.83 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 121.65 -0.656 . . . . 0.0 111.062 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.4 mt -74.15 -44.43 53.63 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 774' ' ' LEU . 2.3 pp -59.96 -37.14 71.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 121.98 -0.45 . . . . 0.0 111.419 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 26.7 m -65.92 -43.17 93.0 Favored 'Isoleucine or valine' 0 C--N 1.346 0.42 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.757 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 47.2 p -63.81 -46.6 84.39 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.433 -0.792 . . . . 0.0 111.508 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.11 -30.32 71.5 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.35 -35.24 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 O-C-N 121.847 -0.533 . . . . 0.0 110.563 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 17.1 m -53.76 -38.33 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -62.69 -43.22 99.37 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.761 0.791 . . . . 0.0 110.216 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 22.5 tp -68.03 -40.98 82.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.359 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 tp -86.03 -11.07 53.85 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.988 0.423 . . . . 0.0 111.826 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -72.25 1.41 34.39 Favored Glycine 0 CA--C 1.54 1.65 0 O-C-N 121.75 -0.593 . . . . 0.0 112.488 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -116.12 151.94 34.63 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.732 -0.863 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.524 179.753 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.2 mm? 61.91 112.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.227 0.536 . . . . 0.0 109.865 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 170.99 -176.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 5.7 tp -54.33 -48.42 71.39 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 122.171 0.986 . . . . 0.0 109.663 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -65.4 -32.44 74.07 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.541 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -78.73 -44.18 24.07 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.151 0.5 . . . . 0.0 110.726 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.73 -44.08 62.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.299 0.571 . . . . 0.0 111.319 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.57 -30.28 71.2 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.999 0.428 . . . . 0.0 111.534 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 24.5 p -63.35 -25.79 68.46 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.068 0.461 . . . . 0.0 111.699 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.05 -38.67 86.99 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.304 0.574 . . . . 0.0 110.963 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -61.71 -12.98 19.05 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.978 0.418 . . . . 0.0 111.537 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.64 -32.28 20.65 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.241 0.543 . . . . 0.0 111.252 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.57 -52.19 64.4 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.48 0.657 . . . . 0.0 110.507 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 33.1 t80 58.19 27.76 15.56 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.409 0.623 . . . . 0.0 112.184 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -141.07 -71.17 0.36 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.436 0.636 . . . . 0.0 110.455 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -36.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.4 m -51.28 -33.49 28.86 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.039 -0.413 . . . . 0.0 111.539 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.94 -50.31 73.01 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -66.16 -41.86 89.77 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.933 0.873 . . . . 0.0 109.422 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.07 -35.52 71.49 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -109.46 -31.19 7.61 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -68.22 -6.76 25.34 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.451 -0.781 . . . . 0.0 112.91 -177.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.479 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 0.2 OUTLIER -60.41 -36.29 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.6 -0.688 . . . . 0.0 110.839 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -53.32 -47.6 69.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.615 0.245 . . . . 0.0 111.028 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.54 -35.64 57.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.479 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.7 -31.07 69.25 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.064 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.89 -47.28 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.774 -0.579 . . . . 0.0 109.918 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.71 -41.67 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.72 -37.94 73.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -60.18 -40.15 82.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.41 -27.1 67.24 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 19.9 m -60.78 -45.38 94.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.422 HD13 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -33.13 71.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -176.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.422 ' H ' HD13 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.86 -43.93 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.932 0.787 . . . . 0.0 109.739 -178.7 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.05 -32.68 83.11 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.46 -37.48 81.12 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 122.067 0.937 . . . . 0.0 110.769 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -55.87 -28.49 56.8 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . 0.427 HG23 HD12 ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.59 -36.39 59.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 O-C-N 120.978 -1.076 . . . . 0.0 110.419 -176.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -56.82 -30.22 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 121.253 -0.905 . . . . 0.0 110.561 178.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -56.53 -30.92 63.61 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.711 -0.618 . . . . 0.0 110.317 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.69 77.75 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -41.82 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.48 -37.74 73.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.077 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.7 m -62.86 -35.46 80.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 110.537 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.77 -43.21 97.07 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 122.406 1.098 . . . . 0.0 108.997 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.39 -45.49 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.201 1.001 . . . . 0.0 109.354 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.5 m-80 -62.82 -35.58 80.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.199 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 16.1 ttm-85 -66.41 -50.25 64.06 Favored 'General case' 0 N--CA 1.44 -0.934 0 O-C-N 121.301 -0.874 . . . . 0.0 110.688 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . 0.567 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.9 OUTLIER -78.72 -45.07 25.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -179.143 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -61.38 -45.23 95.24 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.4 pt20 -104.54 -22.89 13.2 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.66 167.64 11.03 Favored Glycine 0 CA--C 1.534 1.231 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.82 -83.6 0.55 Allowed 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.795 -0.827 . . . . 0.0 112.65 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.8 m -62.87 159.44 45.47 Favored Pre-proline 0 N--CA 1.463 0.184 0 O-C-N 121.331 -0.855 . . . . 0.0 110.177 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -30.08 108.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.529 2.153 . . . . 0.0 113.372 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.44 ' O ' ' C ' ' B' ' 716' ' ' SER . 4.8 tt -70.92 -20.38 62.49 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.44 ' C ' ' O ' ' B' ' 715' ' ' LEU . 12.4 t . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 122.402 1.096 . . . . 0.0 112.91 -178.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 11.9 mp0 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 mtp85 -72.24 -28.51 63.2 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.202 0.525 . . . . 0.0 110.975 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.9 -5.19 1.92 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.87 -32.71 61.1 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.701 -1.249 . . . . 0.0 109.423 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -58.59 -34.61 71.29 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 122.08 0.943 . . . . 0.0 108.553 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . 0.442 HH21 ' HG2' ' B' ' 744' ' ' ARG . 0.0 OUTLIER -63.54 -46.96 83.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 122.141 0.972 . . . . 0.0 109.135 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 13.8 t -62.34 -47.18 85.37 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.783 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.4 mp -52.63 -21.4 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 O-C-N 121.24 -0.912 . . . . 0.0 109.655 178.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -43.54 98.64 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.669 -0.645 . . . . 0.0 110.542 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.59 -15.37 2.84 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.668 -0.645 . . . . 0.0 111.964 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.44 -53.76 32.57 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -72.59 -17.77 61.66 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.125 174.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.0 -20.06 32.74 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.857 -177.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 3.5 m -58.47 -38.45 77.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 118.356 1.078 . . . . 0.0 109.572 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.33 -48.04 58.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.65 0.738 . . . . 0.0 109.731 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.56 81.38 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -45.24 92.87 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.649 -0.657 . . . . 0.0 110.627 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mt -62.01 -36.4 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.11 -30.96 69.34 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.952 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -55.94 -48.32 75.96 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.56 -45.32 65.67 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.034 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.9 mt -66.91 -31.79 72.61 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -79.98 -49.47 11.79 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.2 m -65.24 -45.23 85.48 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.543 -0.723 . . . . 0.0 111.576 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.66 -53.25 50.48 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.838 -0.539 . . . . 0.0 112.447 -178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 3.0 m -97.5 -47.57 5.61 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 1.8 mt 71.63 107.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.8 0.81 . . . . 0.0 110.315 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.89 -78.45 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.881 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -110.11 175.47 5.42 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.612 0.72 . . . . 0.0 111.572 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -84.22 -27.96 27.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.064 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.61 -40.14 82.43 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 122.109 0.957 . . . . 0.0 109.149 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.62 -29.26 67.88 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.892 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.16 -32.33 69.79 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.679 -0.638 . . . . 0.0 109.986 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -56.78 -32.51 65.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.03 -41.26 99.47 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 2.7 tp -58.86 -38.49 78.9 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-O 121.388 0.613 . . . . 0.0 110.835 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.34 -37.04 74.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.275 0.56 . . . . 0.0 109.997 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.42 -34.85 68.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.056 0.455 . . . . 0.0 110.592 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.3 -39.26 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.089 0.471 . . . . 0.0 109.779 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 58.6 t -66.28 -46.63 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.784 -0.572 . . . . 0.0 109.945 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -44.48 91.82 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 122.079 -0.388 . . . . 0.0 112.023 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -31.5 72.04 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 122.052 -0.405 . . . . 0.0 111.739 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -36.6 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 O-C-N 121.727 -0.608 . . . . 0.0 112.07 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 5.4 m -59.22 -41.78 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 121.655 -0.653 . . . . 0.0 112.083 -177.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -41.85 91.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.273 0.559 . . . . 0.0 111.338 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.68 -44.04 67.84 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 18.9 tp -83.78 -22.87 31.72 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.027 0.441 . . . . 0.0 111.73 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.67 -33.21 62.49 Favored Glycine 0 CA--C 1.533 1.217 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -83.19 146.99 28.3 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.398 0.618 . . . . 0.0 110.581 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.476 179.691 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 CA-C-O 120.641 0.258 . . . . 0.0 110.784 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 25.7 mt 59.62 110.74 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.519 0.676 . . . . 0.0 110.852 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.6 171.1 10.55 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 121.244 0.545 . . . . 0.0 109.711 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -50.48 72.41 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.62 0.724 . . . . 0.0 110.054 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -75.18 -16.86 60.48 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.908 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -80.96 -49.01 11.5 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.022 0.439 . . . . 0.0 110.881 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -62.71 -46.14 89.52 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.248 0.547 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.23 -23.54 67.47 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -30.55 68.24 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 122.003 -0.436 . . . . 0.0 111.781 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -39.67 94.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -59.47 -13.51 9.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.762 -0.586 . . . . 0.0 111.848 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -81.77 -21.11 37.99 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.277 0.561 . . . . 0.0 110.899 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -62.44 -42.22 99.3 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.648 0.737 . . . . 0.0 110.138 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 61.37 24.76 14.82 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -154.09 -72.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.562 -0.711 . . . . 0.0 112.313 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -37.1 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-O 121.52 0.676 . . . . 0.0 110.257 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.8 m -52.2 -33.7 42.16 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.778 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -56.52 -48.88 76.31 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 121.63 0.729 . . . . 0.0 109.341 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.8 t90 -58.86 -38.09 77.97 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.874 -0.516 . . . . 0.0 109.8 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 9.4 mt -60.72 -41.08 94.6 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -103.27 -39.22 6.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -68.87 -18.56 64.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.3 pp -60.45 -36.57 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.449 -0.782 . . . . 0.0 109.947 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 12.4 ttt-85 -53.7 -46.98 70.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.02 -35.23 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.97 -36.77 77.83 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.994 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 18.5 mm -60.78 -45.53 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.89 -38.43 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.91 -37.99 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.5 -40.01 72.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.29 -37.54 73.87 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.0 m -67.37 -38.64 85.08 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.452 1.12 . . . . 0.0 109.661 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -46.12 89.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.406 -177.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -60.29 -43.63 93.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 O-C-N 122.017 -0.427 . . . . 0.0 110.812 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.74 -30.68 73.17 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.6 tt -53.77 -37.22 63.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.058 0.932 . . . . 0.0 110.139 179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -55.69 -27.85 52.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.7 tt -57.66 -35.41 50.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.079 -1.013 . . . . 0.0 110.831 -175.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -29.86 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.223 -0.923 . . . . 0.0 109.527 177.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -56.83 -31.69 65.0 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.263 -0.898 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.14 -45.3 93.51 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 45.3 t -65.82 -35.86 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.009 177.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -64.95 -44.89 87.95 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.231 0.539 . . . . 0.0 110.865 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 36.3 p -64.13 -33.04 74.88 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.15 0.5 . . . . 0.0 110.776 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.75 95.23 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.833 0.825 . . . . 0.0 108.922 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.62 -45.81 84.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-O 122.149 0.976 . . . . 0.0 108.618 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.06 -36.48 83.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.224 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -49.21 73.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.208 0.528 . . . . 0.0 111.26 -177.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -76.73 -42.98 34.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.501 0.667 . . . . 0.0 111.511 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -70.38 -41.35 73.18 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -102.23 -22.13 14.23 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.759 0.79 . . . . 0.0 112.973 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.35 160.37 24.21 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -112.98 -47.63 3.03 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.936 -0.743 . . . . 0.0 111.536 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 713' ' ' SER . . . . . 0.567 ' HA ' HG21 ' B' ' 708' ' ' VAL . 79.5 p -69.11 144.28 95.14 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 118.616 -0.707 . . . . 0.0 110.306 -179.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -35.23 97.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.553 0 C-N-CA 122.261 1.974 . . . . 0.0 112.394 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 13.6 tp -75.19 5.1 5.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.82 0.819 . . . . 0.0 112.277 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 122.422 1.106 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -61.1 -26.55 67.74 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.61 -1.177 . . . . 0.0 112.084 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.7 -11.59 1.0 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -68.42 -40.89 81.03 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.53 -0.731 . . . . 0.0 111.46 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.33 -36.02 72.78 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 122.031 -0.418 . . . . 0.0 110.501 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -71.34 -46.73 59.84 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.337 0.589 . . . . 0.0 110.017 178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 3.1 p -59.93 -38.51 82.62 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.469 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -19.67 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -59.55 -28.11 66.81 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 15.7 mt -55.65 -20.39 13.8 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.915 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 70.7 t -56.0 -54.89 21.82 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -73.29 -21.9 60.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.784 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.15 33.32 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.206 -178.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 37.5 m -58.59 -37.73 76.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 117.921 0.861 . . . . 0.0 109.315 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -69.45 -50.44 45.55 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.496 0.665 . . . . 0.0 109.743 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.2 -35.36 80.06 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -59.82 -45.34 92.67 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 111.158 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 64.4 mt -67.77 -41.77 85.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.86 0.838 . . . . 0.0 109.338 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.14 -30.09 68.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.207 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -55.32 -48.87 73.5 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.495 -0.753 . . . . 0.0 109.987 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -70.58 -44.72 66.76 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.876 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 62.3 mt -68.88 -36.08 77.66 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 26.2 mtm180 -72.39 -50.02 29.63 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.965 -0.459 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.5 t -64.87 -44.45 89.65 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 122.159 0.981 . . . . 0.0 110.337 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.94 -53.17 28.36 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.212 -0.903 . . . . 0.0 113.225 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.3 m -96.78 -37.47 10.26 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 56.5 mt 62.06 116.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.466 0.651 . . . . 0.0 110.128 -178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 2.0 t80 59.29 -162.96 0.23 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.874 -0.516 . . . . 0.0 109.997 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 p -83.38 91.89 7.43 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.667 0.746 . . . . 0.0 111.671 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 42.42 -165.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.888 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 10.9 t60 75.91 -61.42 0.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -61.31 -30.06 70.26 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.702 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.04 -30.8 69.43 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 122.075 -0.391 . . . . 0.0 109.957 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -56.69 -35.15 68.15 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -67.12 -37.06 83.23 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -58.06 -38.49 76.41 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.064 0.459 . . . . 0.0 110.21 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.98 -37.59 77.16 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 110.943 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 51.1 mt -75.09 -39.99 60.33 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 121.675 -0.641 . . . . 0.0 111.339 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 29.1 mt -62.49 -37.49 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.563 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 7.8 m -55.16 -39.83 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.202 0.91 . . . . 0.0 110.015 -178.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 5.8 m -63.41 -39.8 95.47 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 121.871 0.843 . . . . 0.0 109.741 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.43 -37.55 83.2 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.536 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.422 HG23 ' HB ' ' A' ' 746' ' ' ILE . 89.4 mt -61.69 -47.69 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.41 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.427 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 20.7 m -54.13 -37.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 119.23 -0.988 . . . . 0.0 110.677 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -61.75 -41.28 97.48 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.318 0.58 . . . . 0.0 111.694 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.76 -44.69 76.9 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.559 ' HB3' ' HD3' ' A' ' 747' ' ' ARG . 0.5 OUTLIER -80.01 -27.45 39.57 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.093 -1.004 . . . . 0.0 110.713 -178.185 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.29 -33.8 39.63 Favored Glycine 0 CA--C 1.534 1.223 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.13 143.67 50.81 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 122.186 -0.597 . . . . 0.0 110.178 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.544 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 121.669 0.747 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mt 61.92 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.996 0.903 . . . . 0.0 111.82 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 174.81 163.59 0.23 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.495 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -46.36 -41.48 13.52 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.64 0.733 . . . . 0.0 110.148 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -33.87 76.97 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.774 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -74.8 -44.77 47.7 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.417 0.627 . . . . 0.0 109.782 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -63.12 -46.39 87.53 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.436 0.636 . . . . 0.0 110.364 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.19 61.82 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.493 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 2.7 m -65.38 -33.25 75.52 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.35 -23.75 67.07 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.808 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -60.02 -29.47 68.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.933 -0.48 . . . . 0.0 111.586 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.8 -14.48 62.78 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 19.4 m95 -68.44 -49.63 58.5 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.439 0.638 . . . . 0.0 110.108 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 13.3 t80 65.83 2.77 2.28 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -126.04 -66.78 0.91 Allowed 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.279 -0.888 . . . . 0.0 111.942 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.42 -36.92 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 121.368 0.604 . . . . 0.0 111.025 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.07 -33.38 38.96 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.471 -178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -56.4 -49.57 74.1 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.507 0.67 . . . . 0.0 109.777 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -65.36 -43.9 89.34 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 121.084 0.469 . . . . 0.0 109.809 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.6 mt -61.92 -34.85 76.83 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.9 t90 -103.52 -15.03 15.97 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -94.5 -9.19 36.15 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . 0.467 ' HA ' ' HB2' ' A' ' 685' ' ' PHE . 0.2 OUTLIER -62.38 -35.95 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 O-C-N 121.371 -0.831 . . . . 0.0 110.818 179.054 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -47.42 68.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.783 0.325 . . . . 0.0 111.266 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.5 mp -70.9 -35.34 59.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -60.61 -29.0 68.94 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.584 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 15.9 mm -60.52 -51.06 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.739 -0.601 . . . . 0.0 110.123 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.62 -41.03 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.93 -37.49 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.31 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 61.6 t -54.86 -43.29 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -52.68 -40.08 55.44 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.9 m -65.49 -38.67 90.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.848 0.832 . . . . 0.0 109.615 177.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.73 -43.05 94.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.304 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.36 -42.7 94.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-O 121.126 0.489 . . . . 0.0 109.951 -178.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.85 -24.92 65.17 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 178.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.92 -38.61 70.51 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.021 0.915 . . . . 0.0 109.185 179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.0 mmt180 -55.72 -28.15 54.26 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.827 0.851 . . . . 0.0 111.775 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.99 -39.09 77.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.74 -30.76 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.662 -0.649 . . . . 0.0 109.963 176.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.9 m-85 -55.76 -29.34 59.45 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 122.003 -0.436 . . . . 0.0 110.692 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.56 -37.24 72.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.9 m -60.71 -35.98 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 O-C-N 121.701 -0.624 . . . . 0.0 109.503 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.92 -44.62 91.35 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.81 -0.556 . . . . 0.0 109.88 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -34.66 77.78 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 122.117 0.96 . . . . 0.0 108.819 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.427 HD21 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -60.63 -44.29 96.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 122.308 1.052 . . . . 0.0 108.272 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.2 t -66.81 -41.81 88.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.889 177.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -62.34 -36.91 83.68 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.036 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . 0.427 HH22 HD21 ' A' ' 704' ' ' LEU . 36.0 ttm105 -57.65 -49.49 76.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 120.833 -1.167 . . . . 0.0 110.481 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -76.97 -45.21 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.147 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -74.71 -18.33 60.53 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -101.26 -21.01 15.01 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 120.15 13.64 5.83 Favored Glycine 0 CA--C 1.542 1.78 0 O-C-N 121.604 -0.685 . . . . 0.0 113.115 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 59.29 -83.77 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 O-C-N 121.934 -0.745 . . . . 0.0 112.069 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 92.2 p -102.77 159.99 27.62 Favored Pre-proline 0 C--N 1.347 0.462 0 O-C-N 121.2 -0.938 . . . . 0.0 109.721 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -41.75 106.57 0.07 OUTLIER 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.386 1.391 . . . . 0.0 111.104 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.82 -20.64 13.53 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -175.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 121.498 0.666 . . . . 0.0 111.723 -179.642 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 . . . . . 0 C--O 1.237 0.395 0 CA-C-O 121.714 0.768 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -57.91 -26.29 62.0 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.305 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -15.65 2.87 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.915 -0.49 . . . . 0.0 111.394 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -62.61 -46.12 89.73 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.858 -0.526 . . . . 0.0 109.898 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -59.15 -33.89 71.44 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.849 0.833 . . . . 0.0 109.043 178.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.54 66.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.721 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 8.4 p -58.44 -44.46 89.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.835 -0.541 . . . . 0.0 110.204 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.52 -20.9 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.245 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 -59.14 -24.29 62.9 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.468 -0.77 . . . . 0.0 110.178 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.59 -17.87 62.9 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.984 -0.448 . . . . 0.0 111.576 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.427 HG23 ' ND2' ' A' ' 750' ' ' ASN . 29.9 m -55.76 -54.91 21.06 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 O-C-N 120.793 -1.192 . . . . 0.0 110.78 -178.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.427 ' ND2' HG23 ' A' ' 749' ' ' VAL . 1.2 m-80 -72.75 -21.42 61.02 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 173.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.68 30.82 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.699 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 3.3 p -57.92 -37.79 74.73 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.808 0.804 . . . . 0.0 109.261 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.9 tp -65.38 -49.48 69.15 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.98 -34.58 76.41 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.703 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 7.0 tt -58.77 -44.85 90.74 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 122.013 -0.43 . . . . 0.0 111.477 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 6.7 mm -63.04 -33.33 60.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.29 -30.02 68.01 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.494 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.531 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 30.5 m-20 -54.97 -47.13 74.97 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.672 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.58 -45.2 65.83 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.733 0.778 . . . . 0.0 111.043 178.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 24.2 mt -62.54 -29.58 70.67 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 44.7 mtt85 -81.07 -23.28 38.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 9.9 t -75.75 -46.83 28.71 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.88 -1.137 . . . . 0.0 111.955 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -54.37 14.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 18.4 p -98.09 -36.97 9.92 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 73.35 -61.62 0.49 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.142 0.577 . . . . 0.0 110.745 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -139.13 -68.74 0.43 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.602 -0.686 . . . . 0.0 111.048 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.9 m -79.78 126.3 30.79 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.982 -0.449 . . . . 0.0 110.02 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -57.3 -20.42 28.16 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.967 0.413 . . . . 0.0 110.926 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.1 -40.19 95.02 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.982 0.896 . . . . 0.0 108.745 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -55.86 -29.22 59.54 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.268 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.3 -38.47 80.31 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.957 -0.464 . . . . 0.0 111.608 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -64.63 -32.83 74.67 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.333 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.75 -42.42 99.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.091 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.45 -42.19 86.83 Favored 'General case' 0 C--N 1.354 0.776 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.346 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.4 tp -59.06 -36.86 75.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.017 0.437 . . . . 0.0 112.163 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 26.5 mt -74.57 -44.39 51.12 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.953 -0.467 . . . . 0.0 111.529 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 34.3 pt -68.4 -37.19 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 O-C-N 122.119 -0.363 . . . . 0.0 111.312 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.74 -46.6 96.19 Favored 'Isoleucine or valine' 0 C--N 1.345 0.387 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.166 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 779' ' ' THR . . . . . 0.443 ' O ' HG23 ' A' ' 782' ' ' VAL . 36.7 p -64.66 -36.71 85.14 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.872 0.844 . . . . 0.0 110.813 177.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -43.87 77.24 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 35.3 pt -69.97 -36.73 70.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 779' ' ' THR . 21.3 m -55.76 -38.05 49.54 Favored 'Isoleucine or valine' 0 C--N 1.359 1.019 0 CA-C-N 119.427 1.012 . . . . 0.0 109.117 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.08 -50.36 69.35 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 121.826 0.822 . . . . 0.0 110.112 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.5 -41.03 98.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.86 -26.88 64.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.339 0.59 . . . . 0.0 111.188 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -65.46 -13.24 58.11 Favored Glycine 0 CA--C 1.537 1.414 0 O-C-N 122.06 -0.4 . . . . 0.0 112.493 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 26.9 mtm105 -68.77 136.04 52.18 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.822 -0.81 . . . . 0.0 109.881 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.631 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.6 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 60.2 124.12 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.173 0.511 . . . . 0.0 110.598 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' B' ' 664' ' ' ASP . 0.4 OUTLIER -174.64 29.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.604 -0.685 . . . . 0.0 112.025 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' B' ' 662' ' ' GLU . 0.3 OUTLIER 75.06 -42.74 0.49 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.799 0.809 . . . . 0.0 109.657 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . 0.437 ' H ' ' C ' ' B' ' 662' ' ' GLU . 9.7 t70 -79.98 -31.87 39.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.762 0.792 . . . . 0.0 109.874 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.53 -41.54 79.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.507 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 89.1 m95 -75.02 -46.51 34.54 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.338 0.589 . . . . 0.0 111.534 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.29 71.19 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.87 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 88.3 p -62.76 -33.48 75.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.977 0.417 . . . . 0.0 111.474 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.82 -32.02 70.26 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.297 0.57 . . . . 0.0 111.081 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -62.55 -23.26 66.89 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.899 0.381 . . . . 0.0 111.918 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -81.79 -13.06 58.22 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.897 0.38 . . . . 0.0 111.813 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -69.98 -46.69 64.66 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.48 0.657 . . . . 0.0 110.903 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 47.8 t80 57.26 34.39 24.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.73 0.776 . . . . 0.0 110.939 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -140.7 -87.53 0.18 Allowed 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.781 -0.574 . . . . 0.0 111.139 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 18.5 tt -68.2 -35.98 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 O-C-N 121.57 -0.706 . . . . 0.0 112.178 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.2 m -50.38 -32.5 17.68 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.714 -0.616 . . . . 0.0 111.545 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -55.96 -44.86 78.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -43.7 97.14 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.838 0.828 . . . . 0.0 108.905 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.1 tp -57.86 -40.11 79.38 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.815 -178.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -100.85 -3.05 30.55 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -101.47 -23.14 14.38 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.589 -0.694 . . . . 0.0 112.164 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 28.8 pt -60.44 -35.83 65.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 O-C-N 121.875 -0.516 . . . . 0.0 110.494 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 22.3 ttt-85 -53.31 -47.2 69.46 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.792 -0.568 . . . . 0.0 110.098 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 3.1 mp -75.21 -36.3 36.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -27.66 66.58 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.874 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.47 -45.36 97.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.32 -43.57 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 97.0 mt -58.64 -37.74 67.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 45.5 t -61.69 -47.46 93.24 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.936 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.15 -27.06 13.8 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.774 -0.579 . . . . 0.0 112.205 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 37.0 m -60.63 -44.16 96.68 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.404 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.46 -32.39 70.19 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.154 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.404 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.5 OUTLIER -57.71 -44.58 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.301 -0.875 . . . . 0.0 108.694 -178.731 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.46 -31.55 77.88 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 178.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.18 -37.82 67.55 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 122.065 0.936 . . . . 0.0 109.467 178.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 24.0 mmt180 -55.65 -28.55 56.04 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -35.95 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 121.022 -1.048 . . . . 0.0 108.943 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 1.2 p -66.04 -30.2 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 O-C-N 121.901 -0.5 . . . . 0.0 110.269 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 3.4 m-85 -56.12 -30.71 62.49 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.828 -0.545 . . . . 0.0 109.532 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.81 77.29 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 177.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.38 -38.14 76.74 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.451 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 9.2 tp -58.72 -43.67 90.2 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.069 -0.395 . . . . 0.0 110.281 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 80.3 p -63.82 -31.72 73.0 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.778 0.799 . . . . 0.0 109.839 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -47.29 83.99 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 122.531 1.157 . . . . 0.0 109.142 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 56.1 t -70.19 -45.18 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.631 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.82 -36.04 81.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.143 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . 0.411 HH21 ' HG3' ' B' ' 707' ' ' ARG . 4.6 ttm-85 -63.11 -49.28 75.04 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.524 1.154 . . . . 0.0 109.772 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.28 -44.82 30.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 114.27 -1.332 . . . . 0.0 114.183 -178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -70.22 -45.02 67.39 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -175.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.531 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.9 pt20 -104.97 -22.96 13.04 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 127.94 177.43 14.86 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -129.97 -69.45 0.67 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 21.8 m -62.24 159.36 40.03 Favored Pre-proline 0 N--CA 1.467 0.391 0 O-C-N 121.312 -0.867 . . . . 0.0 109.24 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -34.26 102.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.16 1.907 . . . . 0.0 111.884 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.458 ' O ' ' C ' ' B' ' 716' ' ' SER . 0.5 OUTLIER -76.28 -20.0 57.75 Favored 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -175.393 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.458 ' C ' ' O ' ' B' ' 715' ' ' LEU . 77.6 p . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.524 0.678 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.16 -26.51 62.11 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -178.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -13.13 57.68 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.07 71.21 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 121.034 -1.041 . . . . 0.0 112.124 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.44 -45.27 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.28 -37.07 71.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.178 0.513 . . . . 0.0 110.208 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.8 m -57.13 -34.09 68.04 Favored 'General case' 0 C--O 1.231 0.084 0 CA-C-O 120.992 0.425 . . . . 0.0 110.49 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 23.1 mt -57.68 -16.08 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.66 -33.51 71.64 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 177.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.73 -16.16 3.97 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 39.6 t -55.77 -53.69 34.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 177.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.1 -19.93 61.72 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.084 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.87 31.53 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.834 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.22 -37.64 75.23 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.956 -0.732 . . . . 0.0 109.379 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.0 -48.58 57.58 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 108.945 177.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.71 -34.84 73.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.805 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.03 -42.93 91.4 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.992 0.425 . . . . 0.0 111.233 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 46.6 mm -67.77 -35.62 73.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.51 -33.53 74.3 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -55.92 -47.99 76.49 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.208 -0.933 . . . . 0.0 108.889 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.45 -45.13 66.41 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.088 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -46.07 90.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -81.87 -25.4 35.09 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.9 p -71.23 -46.45 61.07 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.944 -1.098 . . . . 0.0 111.648 -177.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.45 -54.59 13.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.85 -33.94 10.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 68.52 88.42 0.11 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.743 0.782 . . . . 0.0 109.95 -176.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 58.98 -86.16 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.036 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -79.85 162.23 25.17 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 121.405 -0.809 . . . . 0.0 110.684 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -92.62 25.29 3.13 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.218 0.533 . . . . 0.0 111.479 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -90.98 -41.89 10.85 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.833 0.825 . . . . 0.0 109.149 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -29.46 70.34 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.32 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.37 -34.12 72.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -60.84 -43.18 98.63 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -69.56 -38.4 77.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -38.03 84.22 Favored 'General case' 0 C--N 1.344 0.341 0 O-C-N 121.659 -0.65 . . . . 0.0 111.308 -179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 20.0 mt -58.67 -37.17 75.43 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.577 -0.702 . . . . 0.0 111.665 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 pp -74.11 -34.29 63.88 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.73 -0.607 . . . . 0.0 112.169 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 10.2 pt -70.39 -36.27 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.076 -1.015 . . . . 0.0 110.005 177.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 57.9 t -55.11 -46.29 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 3.1 t -63.95 -35.64 81.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.484 -0.76 . . . . 0.0 109.581 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 9.7 tpt85 -61.27 -31.88 71.7 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.974 -0.454 . . . . 0.0 110.886 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 7.1 mm -61.19 -48.04 90.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 O-C-N 122.047 -0.408 . . . . 0.0 110.642 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.2 m -55.31 -38.22 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.504 -0.748 . . . . 0.0 111.11 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.61 -52.24 66.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.404 0.621 . . . . 0.0 110.76 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.1 -44.03 66.47 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.605 0.717 . . . . 0.0 111.966 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -14.56 61.39 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.682 -178.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -54.45 -40.88 70.77 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 11.5 ptp85 -100.93 130.55 46.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.334 0.587 . . . . 0.0 109.995 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.172 -0.918 . . . . 0.0 110.88 -179.228 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.125 0.488 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 7.3 mp 60.45 123.02 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.723 0.773 . . . . 0.0 111.392 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 178.8 171.29 0.83 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.85 -49.35 76.98 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.174 0.988 . . . . 0.0 109.238 178.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -67.12 -23.07 65.78 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.561 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -48.73 12.06 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.361 0.601 . . . . 0.0 110.071 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -63.44 -45.21 91.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.553 0.692 . . . . 0.0 110.315 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.75 -18.01 65.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.98 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.37 -33.52 67.3 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.923 -0.486 . . . . 0.0 111.778 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.15 -33.95 72.87 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -62.03 -17.58 57.78 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 121.645 -0.659 . . . . 0.0 111.801 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -86.05 -25.21 26.03 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.244 0.545 . . . . 0.0 111.133 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -62.84 -40.71 98.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.526 0.679 . . . . 0.0 110.237 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 58.35 34.67 24.23 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.093 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -161.03 -69.08 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.531 -0.731 . . . . 0.0 112.274 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -37.81 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 111.168 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.72 -33.91 50.13 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.977 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -65.69 -50.41 65.0 Favored 'General case' 0 C--O 1.223 -0.332 0 O-C-N 121.927 -0.483 . . . . 0.0 110.722 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -44.24 87.8 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.489 0.661 . . . . 0.0 109.797 178.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.14 -35.63 81.41 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.884 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -101.53 -9.77 20.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -92.09 -21.37 20.49 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.475 -0.765 . . . . 0.0 111.201 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.491 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.2 pt -60.71 -37.05 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.822 0.344 . . . . 0.0 110.16 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 -56.9 -47.3 80.84 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.481 0.658 . . . . 0.0 109.798 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.17 -34.16 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . 0.491 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -60.68 -29.91 69.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.469 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 10.0 mm -60.84 -47.89 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.429 0.633 . . . . 0.0 109.415 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -61.62 -40.38 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.82 -37.68 67.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 85.0 t -55.61 -41.12 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.55 -40.35 77.92 Favored Glycine 0 C--N 1.345 1.067 0 N-CA-C 108.813 -1.715 . . . . 0.0 108.813 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.1 -40.23 86.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.052 0.93 . . . . 0.0 109.373 177.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -46.68 89.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.576 -178.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.8 pp -68.53 -41.91 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 121.25 0.548 . . . . 0.0 110.375 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.28 -32.32 76.44 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 178.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.8 tt -60.08 -37.46 79.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.062 0.934 . . . . 0.0 110.158 178.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -55.98 -28.57 57.69 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.1 tt -58.56 -35.42 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.254 -0.904 . . . . 0.0 110.644 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.97 -29.23 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.728 -0.607 . . . . 0.0 110.621 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -54.9 -29.3 55.55 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.732 -0.605 . . . . 0.0 110.533 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.07 -37.63 74.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 3.2 m -68.87 -35.77 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-O 121.645 0.736 . . . . 0.0 109.372 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.12 -37.88 84.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.035 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 22.0 m -62.97 -36.35 83.2 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.248 0.547 . . . . 0.0 110.408 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.1 -40.67 94.88 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.304 1.05 . . . . 0.0 108.841 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.36 -45.1 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 3.2 m120 -63.05 -36.91 85.15 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.021 0.915 . . . . 0.0 110.793 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -51.21 70.61 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.353 1.073 . . . . 0.0 110.596 -178.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -78.3 -45.96 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.555 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.52 -40.24 61.88 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' C' ' 706' ' ' ASN . 0.0 OUTLIER -101.79 -21.44 14.6 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-O 121.665 0.745 . . . . 0.0 112.347 -176.572 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.46 -170.46 18.4 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -134.51 -53.36 0.83 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.863 -0.786 . . . . 0.0 112.059 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.55 145.76 85.26 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.178 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -36.07 110.25 0.07 OUTLIER 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.268 1.979 . . . . 0.0 112.397 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . 0.468 ' O ' ' C ' ' C' ' 716' ' ' SER . 2.9 mm? -74.35 -20.03 60.24 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -177.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 716' ' ' SER . . . . . 0.468 ' C ' ' O ' ' C' ' 715' ' ' LEU . 67.7 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 122.058 0.932 . . . . 0.0 113.082 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 122.151 0.976 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -58.52 -26.31 63.36 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.095 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -55.23 -10.42 0.56 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -75.76 -27.74 58.18 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.549 -0.72 . . . . 0.0 111.687 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -58.55 -44.07 89.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.389 0.614 . . . . 0.0 109.786 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -71.16 -36.08 71.88 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 9.6 t -56.78 -38.71 72.88 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 6.0 mt -52.97 -22.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.84 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -59.35 -27.6 66.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -22.54 39.65 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 122.185 -0.322 . . . . 0.0 111.606 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 83.5 t -55.41 -54.25 27.22 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -72.77 -32.03 65.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.166 -1.379 . . . . 0.0 108.792 174.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.46 -20.65 38.52 Favored Glycine 0 C--N 1.341 0.834 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.806 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 80.6 p -58.77 -37.97 77.45 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.766 -0.843 . . . . 0.0 109.025 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.8 tp -67.34 -48.15 68.37 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.764 0.792 . . . . 0.0 109.986 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.14 77.13 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.29 -45.32 91.59 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.858 -0.526 . . . . 0.0 111.976 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 3.2 pt -73.96 -32.88 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.32 0.581 . . . . 0.0 109.822 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -69.29 -30.32 68.39 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.805 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -55.71 -49.01 74.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.347 -0.846 . . . . 0.0 109.907 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -70.2 -44.45 68.66 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.362 0.601 . . . . 0.0 111.29 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.4 -40.6 97.01 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 111.463 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -78.45 -32.81 48.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.022 0.439 . . . . 0.0 111.405 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 37.5 t -66.63 -43.27 85.13 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.282 1.039 . . . . 0.0 110.063 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 3.2 tp -64.88 -53.57 44.59 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.08 -0.964 . . . . 0.0 113.387 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 23.3 t -97.82 -20.51 17.48 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 64.29 -75.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.745 0.307 . . . . 0.0 110.5 -177.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -108.5 -72.93 0.7 Allowed 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.476 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 23.6 t -133.86 175.71 9.21 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.518 0.675 . . . . 0.0 111.332 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -58.39 -38.3 77.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.152 0.501 . . . . 0.0 110.584 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -53.34 -46.49 69.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 122.105 0.955 . . . . 0.0 108.8 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 48.2 ttm-85 -72.45 -29.57 63.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.953 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -58.68 -29.66 66.78 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -56.39 -32.69 65.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -69.36 -34.52 74.7 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 118.382 -1.327 . . . . 0.0 109.666 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -38.42 82.33 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.35 -36.08 72.9 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.324 1.059 . . . . 0.0 108.304 176.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -37.6 65.82 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.221 178.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.64 -44.92 98.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.501 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 34.5 m -66.25 -40.86 87.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.229 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.1 m -63.14 -47.14 84.0 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.984 0.421 . . . . 0.0 111.881 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -39.23 83.93 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.813 -0.554 . . . . 0.0 111.871 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 94.3 mt -68.95 -41.94 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.768 -178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 26.4 m -55.89 -38.05 50.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.744 0 CA-C-N 119.773 1.169 . . . . 0.0 109.418 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -64.93 -42.16 94.92 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-O 121.699 0.762 . . . . 0.0 110.052 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 11.9 tp -69.47 -35.61 75.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.301 0.572 . . . . 0.0 111.502 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.72 -28.32 55.77 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.413 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.42 -36.95 6.13 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -106.04 137.72 43.48 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.339 -0.507 . . . . 0.0 110.175 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.437 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.444 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 28.1 mt 77.61 112.23 0.07 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.989 0.9 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -176.29 -175.76 0.72 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 2.2 tt -56.07 -42.17 76.27 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.61 -0.681 . . . . 0.0 110.216 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.02 -34.48 64.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.125 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -73.96 -46.03 46.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.105 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -70.03 -45.95 66.1 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.976 0.417 . . . . 0.0 110.934 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.78 -26.55 65.27 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.985 0.421 . . . . 0.0 111.886 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.6 m -69.29 -32.26 71.29 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.292 0.568 . . . . 0.0 111.195 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.47 -31.71 72.48 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.447 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -59.61 -21.95 61.13 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.031 0.443 . . . . 0.0 111.267 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -75.09 -20.75 59.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.093 0.473 . . . . 0.0 111.432 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.83 -42.57 99.19 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.436 0.636 . . . . 0.0 110.973 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.4 t80 60.22 39.75 18.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.838 0.828 . . . . 0.0 110.848 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -160.98 -67.2 0.06 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.842 -0.536 . . . . 0.0 111.296 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.19 -37.13 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 122.131 -0.356 . . . . 0.0 111.83 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.0 m -52.31 -34.36 46.66 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -177.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -65.02 -49.89 68.41 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 121.507 0.67 . . . . 0.0 109.83 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.4 t90 -65.6 -41.22 93.02 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.675 0.75 . . . . 0.0 110.146 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.17 -36.44 83.11 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -94.56 -40.16 10.0 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -74.12 -2.7 25.65 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.692 -0.63 . . . . 0.0 112.556 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -36.94 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 121.646 -0.659 . . . . 0.0 110.284 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -59.49 -47.26 86.19 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.009 -0.432 . . . . 0.0 110.584 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.76 -34.6 71.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.95 -32.05 70.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.483 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 15.7 mm -60.61 -46.73 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.988 0.423 . . . . 0.0 110.216 -179.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 83.8 mt -60.78 -40.36 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.92 -37.03 70.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.107 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 97.9 t -54.58 -40.02 48.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.6 -39.94 95.75 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.9 m -63.4 -38.44 91.14 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.806 0.812 . . . . 0.0 109.694 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.6 -43.95 93.55 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.327 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.31 -42.05 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.007 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.03 -22.5 57.94 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.91 -37.72 85.69 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.999 0.904 . . . . 0.0 109.306 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 2.4 mmt180 -55.51 -28.16 53.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.569 0.748 . . . . 0.0 111.618 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.03 -39.19 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 O-C-N 121.292 -0.88 . . . . 0.0 108.794 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.53 -31.26 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 O-C-N 121.582 -0.699 . . . . 0.0 110.184 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -56.01 -28.91 59.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.962 0.411 . . . . 0.0 110.607 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.48 -37.43 72.91 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 10.3 m -59.29 -35.87 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.539 0.685 . . . . 0.0 109.313 177.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.4 -37.81 62.82 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.525 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.5 m -62.65 -39.49 94.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.607 0.718 . . . . 0.0 110.091 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -41.93 97.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.558 1.17 . . . . 0.0 108.804 178.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 99.0 t -68.87 -37.07 76.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.317 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.56 -39.92 95.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.034 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -57.36 -48.44 79.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 122.348 1.071 . . . . 0.0 110.349 -178.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -72.94 -44.53 57.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.022 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -73.33 -14.47 61.3 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -178.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 8.35 44.47 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 73.14 20.79 80.06 Favored Glycine 0 CA--C 1.541 1.687 0 O-C-N 121.665 -0.647 . . . . 0.0 112.131 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 68.22 -129.29 0.12 Allowed 'General case' 0 CA--C 1.568 1.635 0 O-C-N 121.868 -0.783 . . . . 0.0 111.272 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 5.5 p -62.62 159.26 44.54 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 120.974 -1.078 . . . . 0.0 111.206 -178.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -45.15 97.96 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.46 1.44 . . . . 0.0 112.127 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.61 -20.41 16.35 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.85 0 O-C-N 121.766 -0.584 . . . . 0.0 112.133 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 121.917 0.865 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.7 mtt-85 -58.63 -26.33 63.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.746 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -54.85 -16.97 3.02 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.8 -0.563 . . . . 0.0 111.225 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 53.1 ttp85 -74.79 -46.01 39.75 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.759 -0.588 . . . . 0.0 110.527 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.91 -45.14 93.51 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.504 0.669 . . . . 0.0 110.587 -178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.41 -36.56 71.38 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 98.0 p -62.22 -36.14 81.03 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.204 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.447 ' HB ' HD11 ' C' ' 781' ' ' ILE . 1.2 mp -55.79 -46.76 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 120.577 -1.327 . . . . 0.0 110.283 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.693 ' HB3' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -64.41 -2.2 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.758 -177.165 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.33 -15.53 16.82 Favored 'General case' 0 C--N 1.368 1.398 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . 0.304 2.0 t -53.12 -54.0 19.57 Favored 'Isoleucine or valine' 0 C--N 1.345 0.375 0 C-N-CA 125.13 1.372 . . . . 0.0 107.439 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.477 ' ND2' ' HD3' ' A' ' 747' ' ' ARG . 1.5 m-80 -73.32 -14.34 61.28 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.324 175.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.16 -19.41 31.54 Favored Glycine 0 C--O 1.222 -0.622 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.519 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 94.0 p -57.64 -37.86 74.06 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 117.803 0.801 . . . . 0.0 109.147 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.4 tp -62.55 -51.07 68.84 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.8 -35.14 79.63 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 112.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.4 tt -59.48 -45.45 91.61 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.002 -0.436 . . . . 0.0 111.963 -177.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.2 mt -61.84 -33.52 58.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.2 -30.49 68.68 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.536 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.4 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 5.1 m-20 -55.68 -48.93 74.23 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.319 -0.863 . . . . 0.0 109.271 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -70.64 -43.46 69.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.405 0.622 . . . . 0.0 111.757 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.42 -32.97 74.81 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.308 0.575 . . . . 0.0 112.114 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -74.42 -18.55 60.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.2 t -77.37 -46.4 22.93 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.579 -0.7 . . . . 0.0 111.634 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.09 -55.82 9.59 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -47.24 5.19 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.255 1.026 . . . . 0.0 112.15 -178.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 tt 84.22 -52.96 0.12 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.464 -176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -134.43 -72.6 0.48 Allowed 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.78 -0.575 . . . . 0.0 110.668 178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.9 152.93 19.83 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.884 -0.51 . . . . 0.0 110.323 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 -24.86 66.05 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.942 0.401 . . . . 0.0 110.897 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.18 -42.19 65.99 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.731 0.777 . . . . 0.0 109.54 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -62.95 -30.08 71.29 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.114 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 2.8 tt -59.87 -42.4 93.63 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.859 -0.525 . . . . 0.0 109.709 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -64.72 -33.51 76.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.658 0.742 . . . . 0.0 109.236 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -43.44 98.82 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.919 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 7.7 tt -58.38 -38.46 77.36 Favored 'General case' 0 C--N 1.349 0.544 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.172 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 13.1 mt -58.44 -36.88 74.34 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.774 -0.579 . . . . 0.0 112.028 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.8 -43.07 72.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.914 -0.491 . . . . 0.0 112.173 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 20.5 pt -65.19 -37.69 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 73.0 t -56.09 -45.42 80.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 O-C-N 121.98 -0.45 . . . . 0.0 110.631 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 19.9 p -63.62 -48.39 77.49 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.023 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -67.54 -31.34 71.37 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 36.8 mt -53.66 -36.21 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -178.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 5.2 m -55.63 -37.99 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.368 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -65.45 -44.68 86.51 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 121.503 0.668 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 13.1 tp -69.45 -38.2 77.68 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.158 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.97 -27.23 26.62 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.0 0.429 . . . . 0.0 111.475 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.66 -31.9 3.98 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -89.91 111.37 22.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.67 0.747 . . . . 0.0 110.246 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.799 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 63.53 119.6 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.624 0.726 . . . . 0.0 110.055 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 178.57 177.55 0.45 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.479 0.657 . . . . 0.0 110.172 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.5 tt -48.94 -62.52 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.793 0.806 . . . . 0.0 111.379 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -64.78 -21.16 66.72 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.408 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -79.97 -43.91 21.19 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.924 -0.485 . . . . 0.0 110.677 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -64.81 -46.09 83.47 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.665 0.745 . . . . 0.0 109.964 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.09 -23.74 67.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.771 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 42.8 p -68.45 -30.84 69.79 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.838 -0.539 . . . . 0.0 111.274 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.0 -33.19 72.86 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.485 0.659 . . . . 0.0 110.779 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 64.3 m95 -59.57 -18.87 44.43 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.366 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -84.92 -29.5 25.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.343 0.592 . . . . 0.0 110.744 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.7 m95 -57.6 -47.56 81.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.354 0.597 . . . . 0.0 110.74 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 18.8 t80 59.52 28.11 17.43 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.334 0.588 . . . . 0.0 111.323 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -138.68 -78.23 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.83 -0.544 . . . . 0.0 111.069 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -64.64 -36.98 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.681 -0.637 . . . . 0.0 111.254 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.81 -34.31 39.6 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.073 -0.392 . . . . 0.0 111.916 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -63.36 -50.15 71.08 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 109.575 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -65.65 -40.58 92.61 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-O 121.889 0.852 . . . . 0.0 109.879 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -35.68 81.61 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -101.83 -47.01 4.74 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -59.0 -15.1 11.45 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.61 -0.681 . . . . 0.0 112.224 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.3 pp -60.56 -36.28 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.623 -0.673 . . . . 0.0 110.459 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -53.85 -47.39 71.01 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -68.68 -37.34 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -28.25 67.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.786 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 16.9 mm -60.7 -49.6 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 O-C-N 121.781 -0.575 . . . . 0.0 109.924 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.37 -39.59 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.09 -37.95 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.66 -48.4 87.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.16 -26.75 9.51 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 7.4 m -60.06 -43.85 95.14 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.411 HD11 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.56 -31.84 69.8 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.413 -0.805 . . . . 0.0 112.374 -177.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.411 ' H ' HD11 ' B' ' 692' ' ' LEU . 1.1 pp -57.05 -46.13 84.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.452 -0.78 . . . . 0.0 109.757 -177.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.73 -31.36 77.79 Favored Glycine 0 CA--C 1.54 1.624 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.08 -37.19 66.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.906 0.86 . . . . 0.0 110.434 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.3 mmt180 -55.14 -28.23 51.17 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.53 -36.55 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 O-C-N 120.813 -1.179 . . . . 0.0 108.665 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.4 -30.84 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.418 -0.801 . . . . 0.0 109.65 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.7 m-85 -56.37 -30.64 62.95 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.759 -0.588 . . . . 0.0 109.724 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.64 -37.4 75.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -43.16 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -59.69 -37.97 80.28 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.121 0.486 . . . . 0.0 109.767 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.3 m -62.76 -32.96 74.21 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.219 0.533 . . . . 0.0 109.594 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -40.59 96.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.052 0.929 . . . . 0.0 108.617 177.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -46.17 82.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.564 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.87 -36.61 83.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.8 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.34 -50.18 55.11 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . 0.423 HG23 ' HA ' ' C' ' 713' ' ' SER . 0.5 OUTLIER -77.4 -41.98 30.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.645 0.736 . . . . 0.0 112.434 -179.222 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -58.01 -44.99 87.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.514 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.4 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.2 pt20 -104.61 -25.0 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.333 1.063 . . . . 0.0 113.24 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.95 153.55 8.0 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.511 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -85.85 -33.24 21.35 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 122.05 -0.676 . . . . 0.0 112.135 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.02 155.43 52.49 Favored Pre-proline 0 N--CA 1.471 0.601 0 CA-C-O 118.454 -0.784 . . . . 0.0 109.663 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -36.83 138.24 0.23 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.809 1.673 . . . . 0.0 112.285 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' B' ' 716' ' ' SER . 11.4 tp -100.55 -19.3 16.22 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 715' ' ' LEU . 6.9 t . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 122.346 1.07 . . . . 0.0 112.756 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.547 0.833 0 CA-C-O 122.045 0.926 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 3.1 ttp85 -72.42 -26.22 61.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.898 0.856 . . . . 0.0 111.454 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.32 -6.09 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -176.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -55.33 -39.11 69.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.248 0.931 . . . . 0.0 110.492 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.16 -43.72 87.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.165 0.507 . . . . 0.0 109.82 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.3 -42.86 68.14 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.567 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 93.8 p -56.54 -37.75 70.93 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.862 -0.524 . . . . 0.0 110.903 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.99 -10.28 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.836 177.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . 0.402 ' C ' ' HD3' ' B' ' 747' ' ' ARG . 0.0 OUTLIER -59.0 -27.11 65.12 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 121.211 -0.93 . . . . 0.0 108.863 177.683 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 33.9 tp -54.47 -21.91 11.27 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.643 -177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 92.4 t -55.39 -54.29 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -73.02 -24.7 60.76 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.282 174.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.95 -19.76 31.25 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.025 -0.989 . . . . 0.0 113.159 -176.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 35.6 t -58.17 -37.63 75.08 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.387 1.094 . . . . 0.0 108.993 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 33.1 tp -69.27 -51.07 41.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.152 0.501 . . . . 0.0 110.595 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.63 76.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.78 -45.37 92.51 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.574 -0.704 . . . . 0.0 111.852 -176.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 32.1 mm -64.99 -31.2 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.584 0.707 . . . . 0.0 109.24 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.39 68.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.947 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.21 -49.15 72.67 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.295 -0.878 . . . . 0.0 108.755 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.67 -44.6 66.69 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.455 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 24.6 mt -68.1 -46.27 71.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -177.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -63.38 -42.77 98.86 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.1 p -68.42 -45.45 72.58 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.443 0.639 . . . . 0.0 111.073 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -53.75 20.45 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.829 -0.544 . . . . 0.0 112.39 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.9 p -98.03 -49.35 4.79 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 76.89 92.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.898 0.856 . . . . 0.0 110.412 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 3.1 t80 71.45 -72.93 0.1 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.177 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 19.2 p -98.67 163.28 12.71 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.743 -0.598 . . . . 0.0 111.376 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.87 -33.51 21.24 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.661 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.81 -38.11 64.23 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 122.167 0.984 . . . . 0.0 109.156 178.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 9.6 tpt85 -59.27 -29.64 67.72 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.856 178.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.61 -37.73 79.39 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 110.706 -178.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -58.53 -35.62 72.57 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.128 0.49 . . . . 0.0 110.081 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -69.25 -48.98 60.32 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.138 0.494 . . . . 0.0 110.188 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.4 -37.73 84.5 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.747 0.784 . . . . 0.0 110.137 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.69 -36.92 72.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.58 -178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.15 -33.28 69.9 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 122.19 -0.319 . . . . 0.0 111.45 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 6.3 pt -70.15 -36.88 69.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 O-C-N 121.839 -0.538 . . . . 0.0 110.317 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.72 -46.19 93.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 O-C-N 121.526 -0.734 . . . . 0.0 110.344 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 3.2 t -63.33 -48.18 79.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.934 -0.479 . . . . 0.0 112.226 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.5 -31.68 71.96 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.756 -0.59 . . . . 0.0 111.445 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 22.6 mt -58.34 -36.32 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 121.88 -0.513 . . . . 0.0 110.652 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 5.9 m -53.87 -38.26 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 O-C-N 121.593 -0.692 . . . . 0.0 110.246 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.28 -41.61 96.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.4 0.619 . . . . 0.0 110.573 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.73 -44.13 97.5 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.295 0.569 . . . . 0.0 110.954 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 30.3 tp -79.51 -24.95 41.91 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.007 0.432 . . . . 0.0 110.64 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.51 -43.04 10.43 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -97.78 113.66 25.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.686 0.755 . . . . 0.0 109.776 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.348 -178.564 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 122.398 1.094 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.54 169.26 24.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.884 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -174.58 167.41 3.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.572 0.701 . . . . 0.0 110.532 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.2 -48.69 75.9 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.067 0.937 . . . . 0.0 109.375 178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -28.96 68.51 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.396 179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -71.22 -48.74 49.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.028 0.442 . . . . 0.0 111.018 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -56.84 -46.19 81.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.217 0.532 . . . . 0.0 110.486 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.35 85.65 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.185 0.516 . . . . 0.0 111.448 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 25.5 p -57.78 -34.5 69.65 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.138 0.495 . . . . 0.0 111.293 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 14.8 mt -60.52 -29.06 68.87 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.139 -0.351 . . . . 0.0 111.293 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 51.1 m95 -60.91 -21.11 63.05 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.909 -0.495 . . . . 0.0 110.993 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -84.98 -5.76 59.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 121.03 0.443 . . . . 0.0 111.352 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -89.86 30.65 1.03 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.323 0.582 . . . . 0.0 110.617 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -16.56 135.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 91.52 -48.93 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.688 1.595 . . . . 0.0 111.651 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . 0.403 HG23 HD12 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.82 -42.39 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.535 0.683 . . . . 0.0 111.571 -179.34 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.73 -33.69 49.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.568 -178.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -60.11 -49.92 75.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.391 0.615 . . . . 0.0 109.704 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -65.81 -42.76 90.25 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.685 0.755 . . . . 0.0 109.693 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -35.8 81.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -101.61 -23.27 14.29 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -83.09 -16.07 48.33 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.374 -0.829 . . . . 0.0 112.22 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.5 pp -60.53 -36.47 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 O-C-N 122.043 -0.411 . . . . 0.0 110.226 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -46.86 87.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.75 0.786 . . . . 0.0 109.789 179.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -73.18 -31.33 34.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 CA-C-O 121.423 0.63 . . . . 0.0 109.71 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -28.28 68.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.436 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 8.3 mm -61.79 -42.74 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 121.41 0.624 . . . . 0.0 109.562 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 66.4 mt -65.19 -37.64 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.92 -38.23 72.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 81.6 t -55.7 -40.41 60.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . 0.4 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.13 -40.43 74.42 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 177.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.6 m -66.35 -38.32 87.34 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.019 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.0 tp -60.21 -46.32 90.16 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.572 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . 0.4 HG13 ' O ' ' C' ' 690' ' ' GLY . 1.9 pp -67.88 -41.8 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 O-C-N 121.928 -0.483 . . . . 0.0 111.005 -178.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.39 -26.57 64.36 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.9 tt -66.07 -38.74 89.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.938 0.875 . . . . 0.0 110.138 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.15 -28.69 58.97 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.2 tt -58.77 -35.36 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 O-C-N 121.416 -0.802 . . . . 0.0 110.99 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.9 p -53.89 -29.77 18.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 O-C-N 121.495 -0.753 . . . . 0.0 110.474 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -55.91 -31.68 63.1 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.873 -0.517 . . . . 0.0 110.268 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.82 -37.64 79.76 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -45.13 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -56.69 -39.12 73.25 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.753 178.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.4 m -63.33 -38.84 92.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.997 0.427 . . . . 0.0 110.144 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -41.98 99.28 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.69 -45.61 98.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.84 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.274 1.035 . . . . 0.0 111.055 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . 0.41 ' HD2' ' C ' ' C' ' 707' ' ' ARG . 5.6 tmm_? -57.08 -51.06 70.79 Favored 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 121.301 -0.874 . . . . 0.0 110.654 -177.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -44.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -73.05 -44.19 61.03 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -103.28 -22.05 13.76 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.52 164.74 11.62 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -114.08 -47.62 2.94 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.474 0.654 . . . . 0.0 111.779 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 713' ' ' SER . . . . . 0.423 ' HA ' HG23 ' B' ' 708' ' ' VAL . 9.7 p -97.99 159.5 30.68 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -33.47 121.35 0.12 Allowed 'Trans proline' 0 N--CA 1.5 1.86 0 C-N-CA 122.19 1.927 . . . . 0.0 112.424 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.76 16.61 23.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 O-C-N 121.004 -1.06 . . . . 0.0 110.031 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 N--CA 1.467 0.419 0 CA-C-O 121.935 0.874 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 17.8 tpt85 -64.26 -30.73 71.77 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.333 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.75 -34.03 64.83 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.039 0.447 . . . . 0.0 111.05 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -58.1 -37.41 74.47 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.191 -0.318 . . . . 0.0 111.635 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -58.27 -39.28 78.81 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.461 -0.774 . . . . 0.0 108.975 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -36.46 71.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.376 177.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 54.2 p -61.7 -44.8 96.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.9 -0.5 . . . . 0.0 110.924 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.57 -28.67 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.286 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 4.9 mtm105 -59.81 -22.81 62.7 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.55 -0.719 . . . . 0.0 110.021 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.11 -18.58 65.37 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.031 0.444 . . . . 0.0 110.18 178.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 46.4 t -55.74 -54.66 23.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.579 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -72.9 -21.07 60.97 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.338 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.86 -20.19 32.25 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.518 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.1 p -58.15 -37.62 74.99 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.909 -0.76 . . . . 0.0 109.103 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 13.6 tp -65.63 -51.32 60.48 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.43 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.356 0.598 . . . . 0.0 111.854 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 5.5 tt -59.04 -45.34 90.98 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.0 0.429 . . . . 0.0 111.302 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 50.9 mt -72.08 -37.28 59.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.509 0.671 . . . . 0.0 109.689 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.33 -31.42 69.85 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.78 -45.88 78.05 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.146 -0.971 . . . . 0.0 110.241 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -70.29 -42.86 71.5 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.427 0.632 . . . . 0.0 110.976 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.31 -36.81 83.88 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -82.41 -31.37 29.64 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 68.9 m -73.37 -45.84 52.62 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.538 -0.726 . . . . 0.0 112.751 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -39.0 81.2 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.689 -0.632 . . . . 0.0 112.61 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 4.9 m -91.26 -34.27 15.03 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.832 -0.543 . . . . 0.0 111.53 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.06 60.88 1.43 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 122.304 1.05 . . . . 0.0 109.438 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.6 t80 60.53 160.53 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.327 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 50.4 m 55.69 -160.02 0.2 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -132.83 -34.39 1.14 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.371 -0.83 . . . . 0.0 110.463 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -53.5 -27.55 26.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.682 0.753 . . . . 0.0 109.888 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.48 -30.14 65.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.46 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.66 -30.84 69.03 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.842 -0.536 . . . . 0.0 110.038 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -32.83 67.76 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.657 0.742 . . . . 0.0 109.2 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.33 -34.37 77.56 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.516 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 9.0 tp -57.88 -38.35 75.62 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 121.804 -0.56 . . . . 0.0 110.287 -179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 49.8 mt -58.44 -39.47 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.769 0.795 . . . . 0.0 109.814 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.56 -41.69 60.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.666 0.746 . . . . 0.0 110.691 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.13 -41.57 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.02 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 27.9 m -65.09 -39.69 86.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 O-C-N 121.514 -0.741 . . . . 0.0 110.766 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -45.19 91.07 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 122.041 -0.412 . . . . 0.0 111.489 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -31.63 71.62 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.447 HD11 ' HB ' ' A' ' 746' ' ' ILE . 61.4 mt -64.54 -39.44 85.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 119.051 -0.5 . . . . 0.0 112.157 -178.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . . . . . . . . . 29.2 m -53.16 -37.95 29.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 CA-C-N 119.846 1.203 . . . . 0.0 110.126 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.01 -41.45 99.57 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.157 0.503 . . . . 0.0 111.446 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 41.3 tp -70.17 -44.51 68.64 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 747' ' ' ARG . 0.8 OUTLIER -87.28 -15.8 37.02 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.599 1.091 . . . . 0.0 111.188 -179.472 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.28 -50.15 63.99 Favored Glycine 0 C--N 1.345 1.039 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 178.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 137.14 52.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.015 179.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.292 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 61.4 mt 56.32 92.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.861 0.838 . . . . 0.0 110.927 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -164.58 178.14 7.57 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.054 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.79 -43.93 73.28 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.579 0.704 . . . . 0.0 110.441 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.38 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -73.95 -45.46 50.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.197 0.522 . . . . 0.0 110.943 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -70.18 -46.34 64.81 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.803 0.335 . . . . 0.0 111.174 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.75 -28.38 68.99 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.022 0.439 . . . . 0.0 112.159 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.3 t -65.35 -36.84 85.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.367 0.603 . . . . 0.0 111.022 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -23.65 66.96 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -59.62 -27.85 66.68 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.497 -0.752 . . . . 0.0 111.508 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -67.46 -24.03 65.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.883 -0.51 . . . . 0.0 111.625 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -54.96 -47.58 74.34 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.232 0.539 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 76.3 t80 60.77 7.49 1.46 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -118.01 -73.77 0.63 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.172 -0.955 . . . . 0.0 111.091 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 5.7 tt -68.06 -36.02 73.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 O-C-N 121.959 -0.463 . . . . 0.0 111.78 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 4.3 m -50.99 -33.58 25.35 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 122.033 -0.417 . . . . 0.0 111.351 -176.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.88 -49.2 75.79 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.544 0.688 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -44.29 87.46 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 121.659 -0.651 . . . . 0.0 110.498 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.18 -39.36 89.66 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.2 t90 -89.27 -8.49 53.3 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -107.67 -8.5 16.1 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.551 -0.718 . . . . 0.0 111.833 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.6 pt -60.53 -36.67 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 121.665 -0.647 . . . . 0.0 109.412 178.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.6 ttt-85 -53.45 -47.14 69.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 109.814 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.18 -36.09 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.83 -28.59 67.61 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.485 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 14.1 mm -61.67 -51.98 66.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.358 0.599 . . . . 0.0 109.76 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.18 -36.46 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.728 0.775 . . . . 0.0 109.384 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -36.95 58.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 95.9 t -54.06 -40.07 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.21 -39.67 82.08 Favored Glycine 0 CA--C 1.532 1.119 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.28 -38.51 85.18 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.116 0.96 . . . . 0.0 109.596 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.64 -46.12 89.97 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.172 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.4 pp -68.15 -43.29 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 122.045 -0.41 . . . . 0.0 111.333 -177.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.68 -23.43 60.88 Favored Glycine 0 CA--C 1.54 1.596 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.31 -37.98 79.11 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.256 1.027 . . . . 0.0 108.957 178.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -55.99 -28.45 57.24 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.599 0.76 . . . . 0.0 112.541 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.36 -41.27 83.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.366 -0.833 . . . . 0.0 109.206 -177.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -30.37 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.501 -0.75 . . . . 0.0 109.956 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -28.56 55.31 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.255 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -37.01 71.3 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 4.9 m -58.83 -36.76 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 O-C-N 121.59 -0.694 . . . . 0.0 109.316 177.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -56.15 -38.22 70.55 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 19.4 m -64.06 -39.3 93.78 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-O 121.563 0.697 . . . . 0.0 109.922 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -44.72 96.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.571 1.176 . . . . 0.0 108.533 178.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 40.1 t -64.36 -42.86 96.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 114.411 -1.268 . . . . 0.0 109.128 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.59 -42.12 99.37 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.285 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 mtm105 -60.89 -45.8 93.17 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.138 0.971 . . . . 0.0 111.474 -178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 3.0 t -75.89 -44.66 38.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.221 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -73.76 -14.69 61.16 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -16.23 28.66 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.04 -1.037 . . . . 0.0 113.06 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.98 34.36 3.49 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 121.639 -0.663 . . . . 0.0 111.98 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 55.58 -136.03 1.27 Allowed 'General case' 0 CA--C 1.561 1.4 0 O-C-N 122.031 -0.688 . . . . 0.0 110.828 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 713' ' ' SER . . . . . 0.414 ' HA ' HG22 ' C' ' 708' ' ' VAL . 17.1 m -62.86 157.76 57.78 Favored Pre-proline 0 C--N 1.35 0.611 0 O-C-N 120.859 -1.151 . . . . 0.0 112.106 -178.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -44.6 103.89 0.05 OUTLIER 'Trans proline' 0 N--CA 1.482 0.815 0 C-N-CA 121.763 1.642 . . . . 0.0 112.799 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -105.95 -20.61 13.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.564 0.697 . . . . 0.0 111.594 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 C-N-CA 123.378 0.671 . . . . 0.0 112.437 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 14.0 ttm-85 -59.3 -26.73 65.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.481 -179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -9.06 0.65 Allowed 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.746 -0.596 . . . . 0.0 112.389 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.4 ttm105 -60.0 -41.73 92.72 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.411 -0.805 . . . . 0.0 109.48 179.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.08 -41.11 82.38 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.534 0.683 . . . . 0.0 109.335 178.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -60.04 -46.83 88.23 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.279 -0.888 . . . . 0.0 108.955 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.8 p -69.15 -26.94 65.12 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.464 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 30.7 mt -74.89 -47.41 37.43 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-O 116.565 -1.683 . . . . 0.0 112.014 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.526 ' HB3' HD22 ' C' ' 785' ' ' LEU 0.343 14.1 ttt180 -73.45 -3.85 30.04 Favored 'General case' 0 C--N 1.361 1.109 0 CA-C-N 122.721 2.509 . . . . 0.0 111.47 -178.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.46 -15.4 4.14 Favored 'General case' 0 CA--C 1.577 1.992 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 169.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.464 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.293 1.5 t -53.66 -54.2 20.81 Favored 'Isoleucine or valine' 0 C--N 1.363 1.182 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 175.172 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -72.52 -22.43 61.03 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.158 -1.383 . . . . 0.0 108.686 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.87 -19.39 29.26 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.1 t -57.45 -37.11 72.3 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 51.6 tp -61.31 -49.25 77.76 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.0 -34.75 72.21 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.657 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.67 -45.53 89.18 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.876 -0.515 . . . . 0.0 112.189 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 40.3 mt -61.55 -32.24 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.24 -30.38 68.51 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.76 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . 0.489 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.3 m-20 -55.51 -44.9 77.03 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.855 0.836 . . . . 0.0 109.248 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -70.41 -42.84 71.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.573 0.701 . . . . 0.0 111.372 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 22.6 mt -68.98 -29.85 68.14 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -79.16 -30.13 43.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.9 t -75.26 -45.02 42.71 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.951 0.881 . . . . 0.0 111.61 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.9 -53.59 56.06 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 3.3 m -97.9 -24.11 15.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.353 -0.842 . . . . 0.0 113.237 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.6 mt 66.55 -73.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.906 0.384 . . . . 0.0 109.989 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -135.8 133.76 38.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 109.516 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m 58.48 168.74 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -91.14 -17.56 25.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 120.963 0.411 . . . . 0.0 111.813 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.8 -34.0 77.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.004 0.907 . . . . 0.0 109.773 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -62.64 -29.53 70.7 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.003 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.61 -45.52 91.68 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.891 -0.506 . . . . 0.0 111.928 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 1.3 ptt85 -64.02 -33.74 76.43 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.708 -0.797 . . . . 0.0 109.45 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.33 -39.59 78.08 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.78 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 1.8 tp -59.35 -38.49 80.52 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.971 -0.456 . . . . 0.0 111.2 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.11 -36.75 75.7 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 14.5 mt -67.86 -44.31 77.42 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 781' ' ' ILE . 6.0 pt -58.1 -36.5 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 91.7 t -53.54 -44.53 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 O-C-N 121.911 -0.493 . . . . 0.0 109.904 -177.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 51.7 p -63.79 -36.8 85.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.117 0.96 . . . . 0.0 109.649 177.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -34.11 76.55 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.832 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 777' ' ' ILE . 55.8 mt -68.76 -42.73 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.664 -0.647 . . . . 0.0 110.86 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.29 -38.55 82.43 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 O-C-N 121.467 -0.77 . . . . 0.0 110.343 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -42.86 91.98 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.713 0.768 . . . . 0.0 109.378 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.69 -37.06 85.42 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.496 0.665 . . . . 0.0 109.821 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp -65.27 -33.14 75.27 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.292 0.568 . . . . 0.0 110.251 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -37.67 -32.26 0.1 OUTLIER Glycine 0 CA--C 1.536 1.38 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.445 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -73.35 114.91 12.09 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 24.5 ttp-105 . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 117.774 -1.108 . . . . 0.0 110.481 -179.749 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? 55.61 102.35 0.01 OUTLIER 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.649 0.738 . . . . 0.0 110.392 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.71 176.27 2.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.546 0.689 . . . . 0.0 110.12 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.51 -42.84 61.99 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.465 0.65 . . . . 0.0 110.878 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.67 -36.69 73.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.02 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -71.2 -46.44 61.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.102 0.477 . . . . 0.0 110.864 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -67.46 -45.99 74.36 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.298 0.57 . . . . 0.0 110.89 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -20.14 66.14 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 30.8 t -67.88 -35.28 78.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.168 0.509 . . . . 0.0 110.986 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.86 -29.18 68.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.255 0.55 . . . . 0.0 111.304 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 44.7 m95 -60.3 -27.13 67.06 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 0.0 111.624 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -87.91 -10.3 51.04 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.998 -0.439 . . . . 0.0 112.18 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 10.4 m95 -74.55 -54.24 7.87 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.484 0.659 . . . . 0.0 111.015 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.15 27.77 17.28 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.286 0.565 . . . . 0.0 111.358 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -135.86 -78.69 0.42 Allowed 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.622 -0.673 . . . . 0.0 111.435 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.04 -36.87 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-O 121.64 0.733 . . . . 0.0 110.899 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -51.95 -33.18 36.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.357 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -55.96 -47.71 77.11 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.646 -0.659 . . . . 0.0 109.851 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -59.64 -38.13 80.56 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.879 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.46 -44.41 89.25 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -87.73 -42.15 12.82 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -65.76 -25.59 67.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.5 pp -60.7 -36.64 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.774 -0.579 . . . . 0.0 110.887 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -56.93 -47.18 81.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.165 0.507 . . . . 0.0 110.655 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -68.62 -34.45 65.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -29.9 68.56 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.117 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 12.2 mm -60.85 -49.52 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.199 0.524 . . . . 0.0 109.995 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.26 -42.49 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 88.9 mt -58.79 -37.95 69.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 56.0 t -64.75 -46.82 90.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.08 -27.0 9.58 Favored Glycine 0 CA--C 1.541 1.704 0 O-C-N 121.746 -0.596 . . . . 0.0 112.08 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.9 m -60.37 -43.55 96.44 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.412 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -32.23 70.2 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.513 -0.742 . . . . 0.0 112.361 -177.8 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.412 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.11 -44.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.589 -0.694 . . . . 0.0 109.288 -177.631 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.97 -32.74 81.15 Favored Glycine 0 CA--C 1.538 1.518 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.24 -37.57 72.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.522 0.677 . . . . 0.0 110.908 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 5.8 mmt180 -55.32 -28.93 56.92 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.36 -36.22 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 120.798 -1.189 . . . . 0.0 109.076 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -62.33 -30.36 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 O-C-N 121.691 -0.631 . . . . 0.0 110.157 177.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.3 m-85 -56.2 -30.32 62.12 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 121.737 -0.602 . . . . 0.0 109.5 179.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.4 -37.42 75.28 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 177.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 -39.51 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.03 -36.66 73.04 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.533 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 16.5 m -61.8 -35.38 78.02 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 122.055 -0.403 . . . . 0.0 110.917 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.42 -43.76 93.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.23 1.015 . . . . 0.0 108.361 178.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.93 -42.1 93.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.166 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -62.19 -36.58 82.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.22 0.534 . . . . 0.0 110.856 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -68.63 -49.56 58.26 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 122.612 1.196 . . . . 0.0 110.509 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.37 -45.43 29.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -176.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -65.36 -45.94 82.16 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.437 -174.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 9.5 pt20 -105.92 -24.83 12.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.94 179.81 16.64 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -123.79 -63.84 1.19 Allowed 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.787 -0.831 . . . . 0.0 112.307 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.78 159.29 54.9 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-O 118.562 -0.732 . . . . 0.0 109.738 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -29.87 117.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.813 2.342 . . . . 0.0 112.703 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.3 tt -88.75 5.92 41.12 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 122.023 0.916 . . . . 0.0 110.139 179.762 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 122.104 0.954 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -66.03 -26.33 67.47 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.368 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -5.99 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -33.49 62.8 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.121 -0.987 . . . . 0.0 109.203 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -69.62 -34.03 73.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -47.75 70.03 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.335 178.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 14.5 p -56.87 -34.71 68.1 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . 0.422 HG23 ' HB ' ' A' ' 781' ' ' ILE . 0.3 OUTLIER -52.71 -23.71 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.766 178.138 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -21.63 59.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 4.0 pp -55.16 -23.52 21.9 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 121.274 0.559 . . . . 0.0 109.543 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 7.7 t -55.47 -53.98 30.3 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -72.64 -21.5 61.09 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.692 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.98 -20.6 34.65 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.745 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.6 -42.19 98.51 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 117.936 0.868 . . . . 0.0 109.801 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 15.7 tp -68.39 -47.31 67.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.977 0.894 . . . . 0.0 110.278 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -66.95 -34.19 77.22 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.784 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.6 -45.26 89.52 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.918 -0.489 . . . . 0.0 111.815 -176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 4.1 mp -72.08 -35.1 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.19 -30.8 69.08 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.59 -45.4 77.42 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 120.734 -1.229 . . . . 0.0 109.271 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.67 -46.19 63.68 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 44.9 mt -69.77 -46.24 66.24 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -177.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -49.97 75.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 20.1 p -73.28 -38.33 65.96 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.635 0.731 . . . . 0.0 111.268 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -53.11 46.22 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 34.8 p -98.07 -49.13 4.87 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.516 -0.74 . . . . 0.0 112.041 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 77.52 89.0 0.07 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 122.067 0.936 . . . . 0.0 111.337 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 62.62 -74.74 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.823 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 41.0 t -84.64 162.49 19.72 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.527 0.679 . . . . 0.0 111.747 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -23.18 18.01 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.631 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -67.7 -39.82 84.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 122.059 0.933 . . . . 0.0 109.004 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -58.83 -28.94 66.51 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.46 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 2.6 tt -58.55 -30.72 67.34 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 9.3 mmt-85 -59.89 -32.88 71.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.64 -48.66 66.08 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -37.8 78.27 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.3 1.048 . . . . 0.0 109.662 178.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.34 -36.37 73.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.445 -178.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 66.1 mt -73.86 -31.71 63.31 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.615 -0.678 . . . . 0.0 112.236 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 8.3 pt -70.35 -37.29 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.541 -0.725 . . . . 0.0 111.305 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 35.5 m -66.08 -40.21 86.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.271 -0.893 . . . . 0.0 110.936 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.4 t -63.68 -47.41 81.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.803 -0.561 . . . . 0.0 112.081 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.7 82.1 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.699 -0.626 . . . . 0.0 111.695 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.5 mt -63.97 -43.59 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 O-C-N 122.088 -0.383 . . . . 0.0 111.32 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 18.8 m -59.48 -38.24 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.48 -0.762 . . . . 0.0 109.8 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.32 -42.9 99.43 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.599 0.714 . . . . 0.0 109.674 179.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.62 -42.43 95.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.332 0.586 . . . . 0.0 110.832 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 10.9 tp -82.15 -14.58 55.47 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.041 0.448 . . . . 0.0 111.924 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -53.52 -44.2 67.45 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -75.32 141.67 43.35 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 122.296 -0.532 . . . . 0.0 109.977 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.851 -179.78 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 120.528 0.204 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 18.4 mt 59.96 120.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.668 0.747 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -173.2 172.18 3.91 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.721 0.772 . . . . 0.0 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -51.39 69.64 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 122.079 0.942 . . . . 0.0 109.448 179.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -72.66 -16.64 61.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.759 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 tmtt? -81.08 -46.36 15.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.262 0.553 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -62.18 -46.34 89.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.241 0.543 . . . . 0.0 110.878 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.39 -22.09 66.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.982 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.7 -32.92 73.07 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.975 -0.453 . . . . 0.0 111.434 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.3 -34.16 77.5 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.194 0.521 . . . . 0.0 111.864 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.86 -26.77 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.983 0.421 . . . . 0.0 111.043 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -77.14 -31.75 55.85 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.942 0.401 . . . . 0.0 111.604 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.4 m0 -55.24 -42.65 73.71 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.542 0.687 . . . . 0.0 110.357 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 7.4 t80 55.49 34.58 23.34 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.218 0.532 . . . . 0.0 111.484 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -148.83 -73.7 0.18 Allowed 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.65 -0.656 . . . . 0.0 112.032 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . 0.415 HG23 HD13 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -37.15 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.489 0.661 . . . . 0.0 111.599 -178.708 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -51.63 -33.54 33.8 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.91 -0.494 . . . . 0.0 111.383 -178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -57.29 -49.36 76.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.625 0.726 . . . . 0.0 109.64 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -64.56 -42.15 95.86 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.087 0.47 . . . . 0.0 110.062 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 32.2 mt -66.15 -35.64 81.01 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -99.56 -19.58 16.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -176.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -88.15 -18.17 29.35 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.428 -0.795 . . . . 0.0 112.281 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.466 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.0 pt -63.16 -37.58 79.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 O-C-N 121.945 -0.472 . . . . 0.0 111.786 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -57.18 -47.41 81.3 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.294 0.568 . . . . 0.0 110.044 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -65.96 -32.17 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -61.13 -32.43 72.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.722 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 13.3 mm -61.97 -48.75 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 121.171 0.51 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.96 -41.1 91.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 90.3 mt -59.91 -37.56 72.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 42.6 t -54.7 -41.66 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.42 -42.07 74.0 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.91 -38.23 88.16 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.812 0.815 . . . . 0.0 109.302 177.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.37 -45.99 89.9 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.097 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -41.09 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.662 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.67 -32.48 78.83 Favored Glycine 0 CA--C 1.54 1.619 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.0 -37.34 66.47 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.816 0.817 . . . . 0.0 110.742 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -55.49 -28.37 54.19 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 18.4 tt -58.36 -35.72 55.14 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.267 -0.896 . . . . 0.0 111.603 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 12.8 p -54.26 -30.32 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 O-C-N 121.411 -0.806 . . . . 0.0 109.852 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -57.0 -31.83 65.49 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.525 -0.734 . . . . 0.0 110.52 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.22 95.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.243 1.021 . . . . 0.0 108.603 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.2 -38.74 78.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.926 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 tp -65.7 -40.04 91.88 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.183 0.593 . . . . 0.0 110.393 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -62.93 -31.99 73.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.044 0.45 . . . . 0.0 110.27 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.22 -46.8 85.27 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 122.412 1.101 . . . . 0.0 108.428 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.12 -45.95 97.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.495 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -63.37 -36.58 84.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.128 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 15.2 ttp85 -60.24 -50.04 75.24 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 121.482 -0.761 . . . . 0.0 111.37 -176.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . 0.414 HG22 ' HA ' ' A' ' 713' ' ' SER . 0.5 OUTLIER -77.67 -43.08 29.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -178.183 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.84 -44.73 92.31 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -175.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -103.92 -23.9 13.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.31 -177.3 16.44 Favored Glycine 0 CA--C 1.538 1.477 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -138.73 -43.66 0.48 Allowed 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.534 -0.98 . . . . 0.0 112.229 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 713' ' ' SER . . . . . 0.407 ' O ' ' C ' ' C' ' 714' ' ' PRO . 82.6 p -62.71 147.6 92.82 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 117.704 -1.141 . . . . 0.0 107.924 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' C' ' 713' ' ' SER . 44.8 Cg_exo -28.44 94.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.505 2.172 0 C-N-CA 122.962 2.442 . . . . 0.0 112.212 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.3 mp -69.84 -9.71 55.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.204 -1.362 . . . . 0.0 114.466 -175.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 122.29 1.043 . . . . 0.0 112.386 -178.847 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 122.133 0.968 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 24.7 tpt85 -59.38 -26.99 65.58 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.898 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -34.51 70.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 111.955 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 32.8 mtm105 -67.57 -27.84 67.28 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.97 -37.54 74.4 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.736 -0.603 . . . . 0.0 109.647 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.47 -43.2 67.04 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 121.502 0.668 . . . . 0.0 109.615 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -58.74 -38.12 77.7 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 121.895 -0.503 . . . . 0.0 110.914 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -56.75 -20.0 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -59.57 -25.07 64.26 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.589 -0.694 . . . . 0.0 109.494 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 mt -55.92 -28.8 58.48 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 122.254 -0.279 . . . . 0.0 111.512 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 85.2 t -55.43 -54.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -73.08 -26.91 61.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.331 1.062 . . . . 0.0 109.074 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.29 -20.9 38.15 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.054 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 47.8 m -58.74 -37.85 77.09 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.834 0.817 . . . . 0.0 109.379 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.53 -51.18 38.05 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.721 0.772 . . . . 0.0 109.994 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.58 78.0 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.77 -45.45 89.77 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.768 -0.583 . . . . 0.0 110.785 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . 0.414 HG23 HD12 ' C' ' 756' ' ' ILE . 41.8 mm -69.88 -33.35 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 110.278 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.38 -31.14 69.35 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -55.81 -47.01 77.9 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.064 -1.022 . . . . 0.0 109.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.29 -45.36 66.47 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.991 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 27.3 mt -66.35 -45.45 80.15 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -66.43 -48.78 68.93 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.865 -0.522 . . . . 0.0 112.102 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.1 t -64.94 -45.29 86.4 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 110.759 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . 0.409 ' O ' ' HG ' ' C' ' 774' ' ' LEU . 1.0 OUTLIER -68.34 -54.54 16.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.843 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.89 -47.48 5.54 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.124 -0.985 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' C' ' 766' ' ' PHE . 1.6 tt 72.84 129.91 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -178.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' C' ' 765' ' ' LEU . 32.9 t80 -9.05 123.53 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.902 1.281 . . . . 0.0 114.359 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 767' ' ' SER . . . . . 0.435 ' O ' ' C ' ' C' ' 768' ' ' TYR . 1.3 m 48.94 91.26 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.57 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' C' ' 770' ' ' ARG . 41.3 m-85 3.87 -97.86 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.691 1.197 . . . . 0.0 113.609 -179.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 39.59 -76.96 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.925 0.784 . . . . 0.0 113.103 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . 0.575 ' N ' ' O ' ' C' ' 768' ' ' TYR . 32.1 mmt180 -55.3 -29.01 57.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.465 0.706 . . . . 0.0 110.528 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.22 -38.15 79.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.671 -0.643 . . . . 0.0 109.452 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -38.82 72.94 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -69.32 -34.51 74.78 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.978 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' C' ' 763' ' ' LEU . 3.5 tm? -58.4 -42.61 87.52 Favored 'General case' 0 C--N 1.355 0.813 0 O-C-N 121.759 -0.588 . . . . 0.0 109.606 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 8.3 mp -58.63 -43.05 89.57 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.921 -0.487 . . . . 0.0 111.181 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 9.9 mt -73.0 -33.24 65.65 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.107 0.479 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . 0.513 ' O ' HG12 ' C' ' 781' ' ' ILE . 0.1 OUTLIER -62.35 -37.84 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.7 -42.72 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 122.151 -0.343 . . . . 0.0 110.9 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 1.6 p -63.36 -42.12 98.88 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.229 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -31.71 71.94 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 122.051 -0.405 . . . . 0.0 111.861 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.513 HG12 ' O ' ' C' ' 777' ' ' ILE . 21.3 mm -56.23 -39.73 61.39 Favored 'Isoleucine or valine' 0 C--N 1.347 0.486 0 O-C-N 121.762 -0.586 . . . . 0.0 111.346 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.491 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 21.6 m -52.73 -37.44 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.464 -177.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -55.05 -41.65 71.71 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 2.2 tp -63.66 -45.03 92.01 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -176.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 747' ' ' ARG . 0.6 OUTLIER -78.48 -31.99 48.1 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.577 0.703 . . . . 0.0 109.302 179.765 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.71 -38.24 7.46 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.756 -0.937 . . . . 0.0 110.756 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -95.95 139.14 32.58 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.457 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 120.762 0.315 . . . . 0.0 110.436 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 175.32 129.78 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -171.65 177.81 3.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.923 0.868 . . . . 0.0 111.117 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.1 tt -51.57 -51.1 58.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.721 0.772 . . . . 0.0 110.544 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.9 -30.51 71.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -48.15 37.22 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.406 0.622 . . . . 0.0 110.815 -179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -62.81 -46.08 89.62 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.674 0.75 . . . . 0.0 110.33 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.77 -20.2 65.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.718 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 24.7 t -71.38 -32.07 68.04 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.156 0.503 . . . . 0.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.99 -34.62 73.57 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.897 0.379 . . . . 0.0 111.061 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -59.69 -16.44 26.75 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.842 -0.536 . . . . 0.0 111.313 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -82.63 -26.16 32.48 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.361 0.6 . . . . 0.0 110.732 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -60.31 -42.07 94.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.537 0.684 . . . . 0.0 110.299 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.5 t80 60.56 35.09 20.16 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.543 0.687 . . . . 0.0 111.267 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -156.09 -66.92 0.11 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.619 -0.675 . . . . 0.0 111.652 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -65.55 -37.37 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 O-C-N 121.891 -0.506 . . . . 0.0 111.342 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.48 -34.3 48.55 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.898 -0.501 . . . . 0.0 111.986 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -63.4 -50.53 69.47 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.326 0.584 . . . . 0.0 110.261 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -66.01 -44.12 85.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 122.167 0.984 . . . . 0.0 109.53 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -35.77 77.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.949 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -101.25 -50.53 3.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -59.9 -10.35 3.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.545 -0.722 . . . . 0.0 112.645 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 pp -60.71 -36.33 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 121.657 -0.652 . . . . 0.0 110.368 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -54.63 -47.27 73.68 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.998 0.427 . . . . 0.0 110.403 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.38 -35.99 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.96 -30.51 69.15 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.122 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 12.3 mm -60.58 -50.04 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.374 0.607 . . . . 0.0 109.629 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 79.2 mt -60.84 -39.02 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.1 -36.97 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.049 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 92.7 t -54.17 -40.04 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.237 -0.914 . . . . 0.0 108.554 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.43 -39.2 92.59 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -64.72 -38.21 90.22 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.666 0.746 . . . . 0.0 109.587 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -46.18 89.05 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.502 -178.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -40.29 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.257 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.63 -28.42 67.8 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -61.98 -37.54 85.16 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.488 1.137 . . . . 0.0 109.035 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 29.7 mmt180 -55.73 -27.64 51.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.054 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 mm -58.19 -36.29 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 121.108 -0.995 . . . . 0.0 108.681 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.4 p -61.95 -30.29 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 O-C-N 121.534 -0.729 . . . . 0.0 110.572 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 6.4 m-85 -55.38 -29.07 57.76 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.865 -0.522 . . . . 0.0 110.54 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.14 -36.97 71.34 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 3.7 m -59.36 -36.2 62.62 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 CA-C-O 121.727 0.775 . . . . 0.0 108.967 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -60.89 -38.92 87.34 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.823 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 54.7 m -63.07 -38.86 92.89 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.762 0.792 . . . . 0.0 109.695 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -40.87 95.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 122.179 0.99 . . . . 0.0 109.312 178.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.8 t -68.56 -43.59 83.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.065 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -62.31 -41.79 98.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -66.05 -38.74 89.11 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 121.012 -1.055 . . . . 0.0 111.498 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.35 -43.96 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.955 0.883 . . . . 0.0 108.893 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -73.77 -15.73 61.19 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -87.97 -20.87 25.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.279 -0.888 . . . . 0.0 111.992 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.94 37.99 2.09 Favored Glycine 0 CA--C 1.54 1.638 0 O-C-N 121.6 -0.687 . . . . 0.0 113.094 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' NH1' ' C' ' 707' ' ' ARG . 0.6 OUTLIER 49.17 -133.49 1.5 Allowed 'General case' 0 CA--C 1.566 1.576 0 O-C-N 121.616 -0.932 . . . . 0.0 110.077 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 6.7 p -62.92 159.9 42.17 Favored Pre-proline 0 C--N 1.354 0.784 0 O-C-N 120.925 -1.11 . . . . 0.0 109.138 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -36.81 119.76 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.144 1.896 . . . . 0.0 112.877 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.35 -20.54 12.89 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 122.482 1.134 . . . . 0.0 110.589 -179.612 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 CA--C 1.536 0.437 0 CA-C-O 121.698 0.761 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -58.04 -26.56 62.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.385 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.27 -37.01 74.13 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.695 -0.628 . . . . 0.0 112.133 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . 0.471 ' HD3' ' HB2' ' C' ' 762' ' ' SER . 0.1 OUTLIER -59.2 -46.39 88.54 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.777 -0.577 . . . . 0.0 112.363 -179.051 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -59.46 -44.77 92.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.577 -177.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.84 71.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.931 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 9.2 p -59.82 -42.52 93.68 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 122.113 -0.367 . . . . 0.0 111.438 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . 0.426 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 21.9 mt -65.63 -46.64 88.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-O 116.771 -1.585 . . . . 0.0 113.66 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.745 ' HB3' ' HB3' ' C' ' 785' ' ' LEU . 0.1 OUTLIER -67.59 -5.0 13.42 Favored 'General case' 0 C--N 1.351 0.663 0 CA-C-N 122.204 2.275 . . . . 0.0 109.989 -178.862 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -54.9 -15.13 1.76 Allowed 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.452 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.304 1.3 t -53.1 -53.95 19.77 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 175.087 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.424 HD21 ' H ' ' A' ' 750' ' ' ASN . 1.2 m-80 -72.39 -30.22 64.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 113.999 -1.455 . . . . 0.0 107.727 174.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.71 -19.21 27.36 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 96.0 p -57.28 -36.87 71.57 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.3 -49.21 77.93 Favored 'General case' 0 C--N 1.346 0.457 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 176.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.0 73.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.735 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -59.21 -42.58 91.28 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.857 -0.527 . . . . 0.0 111.239 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 66.1 mt -61.61 -35.68 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.96 -30.61 69.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.199 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.7 -49.22 73.59 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.566 -0.709 . . . . 0.0 109.58 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.75 -43.73 68.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.873 0.844 . . . . 0.0 110.388 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -32.39 70.51 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.924 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -82.27 -31.14 30.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -177.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 35.8 t -66.46 -46.61 75.81 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.397 -0.814 . . . . 0.0 112.766 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -55.05 11.52 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 121.661 -0.649 . . . . 0.0 112.406 -179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 4.5 p -98.26 -49.13 4.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.685 0.755 . . . . 0.0 112.959 -177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 83.76 -70.26 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.663 0.785 . . . . 0.0 110.636 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -128.72 -58.25 1.17 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.792 -0.568 . . . . 0.0 111.051 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.4 m -92.2 132.15 36.87 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.081 0.467 . . . . 0.0 110.126 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . 0.416 ' CZ ' HD23 ' A' ' 771' ' ' LEU . 1.7 t80 -61.77 -13.0 19.67 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.121 -0.362 . . . . 0.0 111.413 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -37.56 87.99 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.926 0.87 . . . . 0.0 108.995 178.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -29.27 59.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.578 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . 0.416 HD23 ' CZ ' ' A' ' 768' ' ' TYR . 24.4 tp -58.97 -39.44 81.73 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 41.5 mtp180 -66.93 -32.96 74.56 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.54 -45.68 74.99 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.679 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.97 -42.29 89.58 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.38 -38.53 91.51 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.689 -0.632 . . . . 0.0 111.005 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.75 -43.96 57.57 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 121.944 -0.473 . . . . 0.0 112.013 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.68 -37.45 77.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.048 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 41.1 t -56.29 -46.17 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 121.791 -0.568 . . . . 0.0 109.706 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 68.8 p -63.52 -46.01 88.01 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.835 -0.541 . . . . 0.0 112.067 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -31.79 72.37 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 56.4 mt -54.77 -36.41 36.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.583 -0.698 . . . . 0.0 110.55 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 13.1 m -54.2 -38.39 38.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 121.23 -0.919 . . . . 0.0 109.753 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.34 -49.22 78.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.626 0.726 . . . . 0.0 110.774 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 31.3 tp -70.01 -42.48 72.94 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.264 0.554 . . . . 0.0 111.92 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.32 -17.95 60.13 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.021 0.439 . . . . 0.0 111.703 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.09 -41.76 11.45 Favored Glycine 0 CA--C 1.533 1.162 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -110.13 151.87 26.72 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 122.062 -0.669 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 8.8 tpp85 . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 118.1 -0.952 . . . . 0.0 110.327 -179.599 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 61.77 115.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.524 0.678 . . . . 0.0 110.327 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -179.72 170.99 1.23 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . 0.403 ' CD1' ' HB2' ' C' ' 660' ' ' LEU . 32.8 tp -64.22 -40.75 96.7 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 121.473 0.654 . . . . 0.0 110.498 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.13 -24.15 67.76 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.379 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -81.26 -43.21 19.53 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -62.02 -46.79 87.64 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 122.006 0.908 . . . . 0.0 110.607 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.22 65.45 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.618 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 7.1 t -72.31 -29.22 63.65 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.819 0.342 . . . . 0.0 111.389 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.91 -32.73 71.03 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 122.185 -0.322 . . . . 0.0 111.179 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -59.66 -20.38 55.76 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.769 -0.582 . . . . 0.0 111.197 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -88.0 -20.41 25.87 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.169 0.509 . . . . 0.0 111.341 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -72.55 -46.7 53.18 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.099 0.476 . . . . 0.0 111.127 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 67.7 t80 58.66 19.86 7.19 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.379 0.609 . . . . 0.0 111.314 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -130.53 -67.72 0.72 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 121.378 -0.826 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -68.27 -37.11 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.891 0.377 . . . . 0.0 110.92 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.15 -33.92 42.42 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.232 -0.293 . . . . 0.0 111.775 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -63.79 -50.35 69.35 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 109.883 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -65.97 -43.08 88.94 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 121.751 0.786 . . . . 0.0 109.754 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -35.75 82.1 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 8.9 t90 -103.93 -26.68 12.56 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -82.24 -10.48 59.11 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.513 -0.742 . . . . 0.0 111.761 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.493 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 4.7 pt -60.85 -36.33 70.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.824 -0.548 . . . . 0.0 110.793 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.5 ttt-85 -53.32 -47.39 69.33 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.925 0.393 . . . . 0.0 110.4 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.7 -35.58 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.03 -29.46 68.52 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.18 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 17.6 mm -60.79 -48.28 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.211 0.529 . . . . 0.0 110.277 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.44 -43.17 94.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 89.4 mt -58.85 -37.71 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . 0.416 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 46.6 t -62.2 -48.77 86.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.5 -27.1 11.12 Favored Glycine 0 CA--C 1.54 1.613 0 O-C-N 121.772 -0.58 . . . . 0.0 111.896 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.0 m -60.61 -39.68 89.07 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.416 ' CD1' ' O ' ' B' ' 689' ' ' VAL . 0.3 OUTLIER -59.62 -32.7 70.66 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.235 -0.916 . . . . 0.0 111.643 -177.619 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.87 -46.96 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.45 -27.39 67.78 Favored Glycine 0 CA--C 1.542 1.737 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 178.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -37.16 67.37 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.758 0.789 . . . . 0.0 110.458 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -55.18 -27.99 49.78 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -36.44 58.1 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 O-C-N 120.792 -1.193 . . . . 0.0 109.465 -177.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.0 p -66.99 -30.25 48.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.477 -0.764 . . . . 0.0 110.169 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -55.88 -30.58 61.77 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.648 -0.657 . . . . 0.0 109.652 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.57 76.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -41.98 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 176.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.08 -37.87 72.51 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.445 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 29.2 m -62.83 -37.0 85.04 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.289 0.566 . . . . 0.0 110.38 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -45.26 93.29 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 122.322 1.058 . . . . 0.0 109.137 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.8 -43.34 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.995 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.36 -36.42 82.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.568 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -63.58 -49.56 72.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 122.404 1.097 . . . . 0.0 110.764 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . 0.465 HG23 ' HA ' ' C' ' 713' ' ' SER . 1.5 t -77.16 -44.9 30.81 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 114.79 -1.095 . . . . 0.0 113.645 -177.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.25 -45.94 92.43 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' B' ' 706' ' ' ASN . 5.1 pt20 -105.77 -24.69 12.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.415 1.102 . . . . 0.0 113.644 178.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 129.63 136.34 4.05 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -73.71 -61.77 1.72 Allowed 'General case' 0 N--CA 1.477 0.913 0 O-C-N 122.002 -0.705 . . . . 0.0 112.072 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 54.9 p -66.35 159.36 73.0 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.632 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -32.5 131.78 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.31 2.007 . . . . 0.0 112.825 -179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . 0.406 ' O ' ' C ' ' B' ' 716' ' ' SER . 7.6 tt -93.74 -20.42 20.15 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -176.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 716' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 715' ' ' LEU . 2.8 t . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 122.17 0.986 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 18.4 tpt85 -65.94 -26.98 67.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.575 0.703 . . . . 0.0 111.275 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -60.83 -6.7 1.9 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -55.73 -39.63 71.39 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.517 -0.739 . . . . 0.0 111.195 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -58.02 -39.69 78.97 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.655 -0.653 . . . . 0.0 109.74 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -68.01 -38.85 83.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.3 p -59.7 -44.68 93.57 Favored 'General case' 0 N--CA 1.462 0.175 0 O-C-N 121.963 -0.461 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.2 mp -55.17 -19.45 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.418 177.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -59.89 -26.63 66.04 Favored 'General case' 0 C--N 1.346 0.428 0 O-C-N 121.594 -0.691 . . . . 0.0 109.437 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -55.49 -20.4 12.7 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 65.2 t -57.43 -54.22 33.84 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 176.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -72.94 -18.0 61.43 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.211 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.06 -20.68 35.56 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.915 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 23.1 p -58.76 -38.05 77.6 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.031 0.916 . . . . 0.0 109.685 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.91 -49.98 58.83 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.243 0.544 . . . . 0.0 110.029 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.52 78.61 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.98 -45.53 88.64 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.582 -0.699 . . . . 0.0 111.604 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 55.9 mt -67.01 -38.59 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 121.835 0.826 . . . . 0.0 109.484 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.01 67.96 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.587 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -55.15 -49.35 72.03 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.734 -1.229 . . . . 0.0 110.05 -178.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.25 -46.36 61.18 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.18 -46.83 63.81 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -63.85 -37.82 88.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.37 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 84.5 p -70.44 -45.17 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.52 0.676 . . . . 0.0 110.957 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -53.7 52.13 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.926 0.714 . . . . 0.0 112.926 -178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.6 p -98.5 -11.82 21.89 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -177.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.41 -154.62 0.34 Allowed 'General case' 0 CA--C 1.552 1.023 0 O-C-N 121.206 -0.934 . . . . 0.0 108.54 -177.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -48.93 -72.61 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.36 -0.837 . . . . 0.0 111.529 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 87.6 p -80.34 177.2 9.13 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.707 -0.621 . . . . 0.0 111.334 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.42 -31.98 13.13 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.978 -0.451 . . . . 0.0 110.722 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -53.89 -35.18 61.32 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.522 0.677 . . . . 0.0 109.854 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -29.57 60.33 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.66 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -59.44 -35.45 74.04 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 121.934 -0.479 . . . . 0.0 110.103 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -39.24 90.63 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -69.18 -45.18 70.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.337 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -37.9 89.04 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.958 0.885 . . . . 0.0 110.564 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -58.75 -36.66 74.72 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.381 0.61 . . . . 0.0 110.539 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.27 -35.61 73.86 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.59 -0.694 . . . . 0.0 112.152 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 21.7 pt -70.29 -37.09 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 O-C-N 121.688 -0.632 . . . . 0.0 111.325 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 3.4 m -61.9 -39.48 83.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 121.132 -0.98 . . . . 0.0 109.857 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 779' ' ' THR . . . . . 0.465 ' O ' HG23 ' B' ' 782' ' ' VAL . 20.4 p -63.69 -47.32 81.66 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.929 -0.482 . . . . 0.0 112.2 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -33.25 74.15 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.405 -0.809 . . . . 0.0 111.269 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 71.0 mt -66.12 -44.57 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.8 -0.563 . . . . 0.0 111.834 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 779' ' ' THR . 24.8 m -59.3 -38.1 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.471 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -57.41 -44.25 84.43 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.798 0.809 . . . . 0.0 109.82 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 25.6 tp -69.98 -43.46 71.44 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.871 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 8.2 tp -65.03 -25.23 67.75 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.964 -0.46 . . . . 0.0 111.15 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -36.17 -47.96 1.1 Allowed Glycine 0 CA--C 1.536 1.363 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.75 97.44 8.08 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.686 -179.076 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . 0.403 ' HB2' ' CD1' ' B' ' 663' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 121.576 0.703 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.32 160.28 15.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.093 0.473 . . . . 0.0 110.818 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 172.81 175.56 0.1 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.29 0.567 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -45.95 86.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.85 0.834 . . . . 0.0 109.622 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -73.3 -22.7 60.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.149 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -46.51 14.58 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.1 0.476 . . . . 0.0 111.145 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -58.8 -46.15 88.26 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.406 0.622 . . . . 0.0 109.602 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.75 -21.04 65.29 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.971 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.1 t -64.86 -35.12 80.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.987 0.423 . . . . 0.0 111.523 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.68 -36.28 76.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.132 0.491 . . . . 0.0 110.98 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -59.55 -22.15 61.29 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.3 0.571 . . . . 0.0 110.768 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -75.93 -29.26 58.29 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.457 0.646 . . . . 0.0 110.736 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -61.52 -41.66 97.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.749 0.785 . . . . 0.0 109.892 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 5.7 t80 58.87 36.03 24.46 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.027 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -160.98 -68.08 0.06 Allowed 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.571 -0.706 . . . . 0.0 112.291 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -37.22 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-O 121.472 0.653 . . . . 0.0 111.415 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -52.41 -33.67 44.81 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 122.014 -0.429 . . . . 0.0 111.444 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -56.83 -49.25 75.98 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.63 0.729 . . . . 0.0 109.745 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -65.14 -40.62 94.67 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.908 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.69 -35.89 82.07 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -92.86 -48.39 6.57 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -60.34 -21.16 61.74 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.902 -0.499 . . . . 0.0 112.086 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.1 pp -60.48 -36.5 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 O-C-N 121.713 -0.617 . . . . 0.0 110.547 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 12.4 ttt-85 -57.65 -47.14 83.09 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.244 0.545 . . . . 0.0 110.257 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.95 -33.25 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 121.67 0.747 . . . . 0.0 109.067 178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -33.99 72.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.037 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 13.0 mm -60.65 -43.48 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.45 0.643 . . . . 0.0 109.498 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -66.01 -41.65 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.25 -38.0 72.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 69.3 t -54.99 -40.42 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.08 -37.82 87.27 Favored Glycine 0 CA--C 1.531 1.058 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -67.29 -37.72 83.86 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.063 0.935 . . . . 0.0 109.465 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.24 -44.55 92.35 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.024 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -62.68 -42.05 94.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 121.242 0.544 . . . . 0.0 109.778 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.62 -33.08 80.65 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.82 -37.93 83.68 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.971 0.891 . . . . 0.0 109.839 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -56.09 -28.3 57.14 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.6 tt -58.44 -36.02 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.258 -0.901 . . . . 0.0 111.206 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.5 p -54.43 -30.18 21.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 121.425 -0.797 . . . . 0.0 110.219 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -56.39 -31.3 63.72 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.822 -0.549 . . . . 0.0 110.293 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.65 82.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -68.72 -42.52 83.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.82 -38.14 84.4 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.496 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.0 m -66.76 -37.12 83.99 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.424 0.631 . . . . 0.0 110.088 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -42.32 97.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.954 0.883 . . . . 0.0 108.821 178.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.0 t -65.08 -45.54 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 122.546 1.165 . . . . 0.0 108.716 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.85 -35.89 81.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.015 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . 0.412 ' NH1' ' CZ ' ' A' ' 712' ' ' TYR . 0.0 OUTLIER -62.56 -49.58 74.72 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 121.685 -0.635 . . . . 0.0 111.336 -177.11 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.0 p -77.47 -44.41 29.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.527 0.68 . . . . 0.0 112.331 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -73.97 -33.11 63.74 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -101.56 -17.68 16.27 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 113.048 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.84 169.87 14.91 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -120.96 -48.56 2.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.217 -0.578 . . . . 0.0 110.962 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 713' ' ' SER . . . . . 0.465 ' HA ' HG23 ' B' ' 708' ' ' VAL . 25.7 p -106.69 157.98 33.86 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.615 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -38.14 96.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.803 0 C-N-CA 121.913 1.742 . . . . 0.0 111.912 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' C' ' 716' ' ' SER . 28.1 tp -73.41 -20.68 60.67 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 716' ' ' SER . . . . . 0.469 ' C ' ' O ' ' C' ' 715' ' ' LEU . 3.2 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.079 0.943 . . . . 0.0 113.04 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.908 0.861 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 tpt85 -71.86 -26.85 62.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.563 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -38.92 84.91 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.24 0.543 . . . . 0.0 110.803 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -62.5 -36.39 82.39 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.102 -0.374 . . . . 0.0 111.319 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -58.46 -39.93 81.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.484 . . . . 0.0 110.102 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.59 -49.33 41.49 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.137 0.494 . . . . 0.0 110.798 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -33.83 67.04 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.012 -0.43 . . . . 0.0 110.699 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -24.43 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 O-C-N 121.469 -0.769 . . . . 0.0 109.095 178.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -59.37 -21.49 59.94 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.62 -27.21 48.31 Favored 'General case' 0 C--N 1.348 0.519 0 O-C-N 122.128 -0.358 . . . . 0.0 110.748 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 90.0 t -55.52 -54.08 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -72.42 -25.8 61.62 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.33 175.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.59 -20.96 40.67 Favored Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.705 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.0 m -59.98 -37.95 81.11 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.752 -0.852 . . . . 0.0 109.386 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.6 tp -66.7 -51.2 58.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.418 0.628 . . . . 0.0 109.889 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.0 79.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.584 0.707 . . . . 0.0 111.365 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.1 tt -59.4 -45.45 91.46 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 -178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.25 -35.04 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.64 0.733 . . . . 0.0 109.325 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.14 68.1 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.471 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -55.36 -46.61 76.46 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.069 -1.019 . . . . 0.0 109.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.69 -45.48 64.93 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.15 -44.0 73.19 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -61.39 -49.8 75.46 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 762' ' ' SER . . . . . 0.471 ' HB2' ' HD3' ' A' ' 742' ' ' ARG . 1.7 p -66.15 -45.31 81.41 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.542 -0.724 . . . . 0.0 110.8 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . 0.439 ' HA ' ' HG ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -59.72 -54.38 47.08 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 -178.408 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.86 -48.72 4.81 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 85.97 -78.61 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -124.59 -86.89 0.63 Allowed 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.483 -0.761 . . . . 0.0 111.337 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 83.4 p -90.13 167.28 12.85 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.56 -0.713 . . . . 0.0 110.225 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.12 -16.18 63.6 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.949 0.404 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -71.12 -44.03 66.42 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -62.69 -30.65 71.55 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.335 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.54 -30.49 69.79 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.828 -0.545 . . . . 0.0 109.86 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -57.25 -38.44 73.83 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.167 -0.333 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.29 -39.2 93.9 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.739 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . 0.439 ' HG ' ' HA ' ' C' ' 763' ' ' LEU . 0.2 OUTLIER -67.39 -38.17 84.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 121.772 0.796 . . . . 0.0 109.872 178.498 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.42 -36.27 73.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.81 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -70.56 -29.68 66.2 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.536 -0.727 . . . . 0.0 110.405 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . 0.41 ' O ' ' HB ' ' C' ' 781' ' ' ILE . 48.2 mt -60.77 -39.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.346 0.415 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.153 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 15.0 m -55.5 -43.83 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 119.067 0.849 . . . . 0.0 113.013 -175.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 2.4 p -64.28 -48.21 76.56 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.107 -0.995 . . . . 0.0 111.615 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -29.13 68.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . 0.496 HG22 ' N ' ' C' ' 782' ' ' VAL . 0.1 OUTLIER -52.98 -36.55 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.6 -175.534 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.496 ' N ' HG22 ' C' ' 781' ' ' ILE . 34.5 m -53.41 -37.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 119.11 -1.036 . . . . 0.0 112.092 -177.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.83 -41.91 87.98 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 6.8 tp -70.67 -45.39 65.16 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 -175.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.745 ' HB3' ' HB3' ' A' ' 747' ' ' ARG . 0.5 OUTLIER -88.2 -17.35 31.03 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 120.625 1.557 . . . . 0.0 112.313 -177.427 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . 0.438 ' HA2' ' CZ ' ' A' ' 747' ' ' ARG . . . -52.91 -26.66 27.13 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 177.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.57 131.74 52.58 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.218 -0.578 0 CA-C-O 118.114 -0.946 . . . . 0.0 110.326 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 6.8 tp . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 48.2 mt 56.82 90.08 0.04 OUTLIER 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.994 0.902 . . . . 0.0 110.267 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -161.7 -177.34 5.82 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.519 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.31 -40.68 62.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.201 0.525 . . . . 0.0 110.512 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -36.02 65.92 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -178.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -43.54 56.95 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.387 0.613 . . . . 0.0 111.075 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -74.0 -45.83 47.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.406 -179.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.52 -35.86 82.13 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.137 0.494 . . . . 0.0 111.337 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -32.79 68.48 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.319 0.58 . . . . 0.0 110.886 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -24.1 67.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.828 0.347 . . . . 0.0 111.487 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -67.95 -19.57 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.003 -0.436 . . . . 0.0 111.688 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -80.88 -17.81 49.36 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.046 0.45 . . . . 0.0 111.508 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.72 -47.98 82.8 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.2 48.01 3.87 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 112.181 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.81 -71.48 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.651 -0.655 . . . . 0.0 112.235 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -66.83 -36.81 78.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 O-C-N 121.804 -0.56 . . . . 0.0 112.054 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.7 m -51.75 -33.21 33.97 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.922 -0.486 . . . . 0.0 112.037 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.38 -49.55 77.37 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.564 -0.71 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -65.78 -44.8 84.7 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.545 0.688 . . . . 0.0 110.583 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -37.43 84.81 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -89.91 -1.93 58.08 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -119.96 0.18 10.74 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.431 0.634 . . . . 0.0 110.619 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 685' ' ' PHE . 2.4 tp -61.66 -36.36 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-O 122.115 0.96 . . . . 0.0 110.112 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -59.39 -44.89 92.72 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.78 -33.66 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' A' ' 682' ' ' ILE . 0.9 OUTLIER -59.66 -33.48 71.6 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.804 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 8.4 mm -60.69 -42.42 91.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.166 0.508 . . . . 0.0 109.9 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -71.82 -39.56 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.4 mt -61.94 -40.69 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.971 -0.455 . . . . 0.0 110.6 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 63.0 t -54.49 -39.46 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.14 -36.54 82.56 Favored Glycine 0 CA--C 1.537 1.456 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.8 m -65.02 -38.16 89.99 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.816 0.817 . . . . 0.0 109.455 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.05 -46.39 88.36 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.704 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.48 -39.89 81.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.596 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.92 -20.74 54.1 Favored Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.219 -0.925 . . . . 0.0 111.014 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -36.68 82.47 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 122.128 0.965 . . . . 0.0 110.151 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 24.9 mmt180 -56.3 -30.18 62.18 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 1.4 pp -60.5 -36.64 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.542 -1.349 . . . . 0.0 108.893 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 1.3 t -67.16 -30.24 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 CA-C-N 115.357 -0.838 . . . . 0.0 108.933 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -27.92 52.45 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 122.871 0.468 . . . . 0.0 110.343 178.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.44 -36.97 69.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.4 m -59.1 -35.69 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -42.6 91.35 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 7.2 m -66.13 -41.16 90.87 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.795 0.807 . . . . 0.0 109.734 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -40.84 94.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.26 -39.61 79.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.448 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 710' ' ' GLN . 1.1 m-80 -62.3 -36.93 83.64 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.102 0.561 . . . . 0.0 111.493 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . 0.429 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 9.0 ttm180 -62.59 -49.47 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.703 0.763 . . . . 0.0 110.252 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' B' ' 713' ' ' SER . 0.9 OUTLIER -77.04 -42.09 31.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.823 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -58.69 -41.37 86.09 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -174.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 706' ' ' ASN . 4.9 pt20 -101.97 -21.87 14.41 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -176.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 164.82 -128.11 1.74 Allowed Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.681 -0.637 . . . . 0.0 112.459 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 712' ' ' TYR . . . . . 0.464 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER -171.85 -116.84 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -178.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 713' ' ' SER . . . . . 0.464 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 7.3 m -62.83 159.4 45.36 Favored Pre-proline 0 C--N 1.352 0.687 0 O-C-N 120.641 -1.287 . . . . 0.0 109.083 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_exo -42.88 101.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.358 1.372 . . . . 0.0 111.699 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.39 -20.79 13.62 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 121.997 0.903 . . . . 0.0 111.671 -179.697 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.98 0.895 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -26.43 62.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.13 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.5 -9.94 0.57 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.8 mtm-85 -64.95 -46.36 81.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.349 -0.845 . . . . 0.0 111.208 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -63.44 -44.69 93.79 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.486 0.66 . . . . 0.0 111.685 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -71.19 -36.86 72.08 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.711 -0.618 . . . . 0.0 110.56 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 89.9 p -64.47 -42.21 96.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.759 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.96 -46.95 90.08 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.872 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.188 -178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 747' ' ' ARG . . . . . 0.595 ' HB3' HD22 ' C' ' 785' ' ' LEU 0.32 14.3 ttt180 -70.26 -0.02 7.23 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 116.153 -2.219 . . . . 0.0 111.699 -176.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 748' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.22 -15.5 6.03 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 169.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 749' ' ' VAL . . . . . 0.43 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.308 1.6 t -52.96 -54.37 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 750' ' ' ASN . . . . . 0.406 ' H ' HD21 ' A' ' 750' ' ' ASN . 1.6 m-80 -72.86 -26.19 61.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 122.611 1.196 . . . . 0.0 108.458 174.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.64 -19.27 27.05 Favored Glycine 0 C--N 1.341 0.831 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.822 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 11.1 p -57.23 -37.29 72.06 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.65 -47.69 84.22 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.12 -35.36 78.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.963 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -45.07 92.18 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.668 -0.645 . . . . 0.0 110.908 -177.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.7 mt -61.65 -37.75 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.62 -33.87 73.27 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.087 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -55.98 -45.11 79.06 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.823 0.82 . . . . 0.0 109.715 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.11 -41.38 74.06 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.432 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.23 -33.94 76.4 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 28.1 mtt85 -73.65 -25.8 60.45 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 60.5 p -77.02 -45.52 26.94 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.624 -0.673 . . . . 0.0 111.217 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 763' ' ' LEU . . . . . . . . . . . . . 10.4 mp -68.39 -54.94 13.84 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.01 -49.3 4.56 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.547 0.689 . . . . 0.0 112.493 -178.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 1.1 tm? 88.62 -72.56 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.184 0.993 . . . . 0.0 109.658 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -118.67 -67.09 1.01 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.773 -0.58 . . . . 0.0 111.157 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.81 148.15 24.73 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.32 0.581 . . . . 0.0 110.842 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -62.62 -23.62 67.15 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.993 0.425 . . . . 0.0 110.878 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.868 0.842 . . . . 0.0 109.628 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -63.57 -29.82 71.02 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.482 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -45.27 92.77 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.02 -39.51 90.03 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.617 0.722 . . . . 0.0 109.322 177.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -64.64 -39.58 93.94 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.7 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.51 -38.74 81.75 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-O 121.109 0.481 . . . . 0.0 111.32 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mt -58.63 -36.99 74.95 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.786 -0.571 . . . . 0.0 111.837 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 6.9 mp -74.04 -44.91 52.64 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.925 -0.484 . . . . 0.0 111.954 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 7.5 pt -64.4 -37.31 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.552 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 79.3 t -57.45 -46.74 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.521 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 37.4 p -63.84 -35.99 82.44 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.21 1.005 . . . . 0.0 110.546 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -45.46 74.28 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.349 -0.842 . . . . 0.0 112.9 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 11.6 pt -69.64 -36.77 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.39 -38.32 79.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.561 0 O-C-N 121.438 -0.789 . . . . 0.0 109.392 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -60.89 -43.47 98.44 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-O 121.545 0.688 . . . . 0.0 109.794 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.63 -39.57 84.66 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.59 0.71 . . . . 0.0 110.44 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.84 -23.51 60.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.58 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -76.55 52.38 3.11 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 14.1 ptt-85 -137.04 124.53 22.11 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 122.111 -0.641 . . . . 0.0 110.536 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 30.6 ttm-85 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.45 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 mm? 61.82 116.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.649 0.738 . . . . 0.0 110.529 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 177.65 178.45 0.32 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.396 0.617 . . . . 0.0 109.988 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 14.8 tp -50.97 -56.35 12.85 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 122.349 1.071 . . . . 0.0 110.71 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -20.21 65.92 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.793 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -81.15 -44.59 17.66 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.329 0.585 . . . . 0.0 110.25 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -74.91 -46.38 36.3 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.512 0.672 . . . . 0.0 111.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.82 63.39 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.559 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 54.4 p -71.58 -31.19 66.68 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.884 -0.51 . . . . 0.0 111.142 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.7 -30.72 68.99 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.09 0.472 . . . . 0.0 110.682 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -59.76 -22.9 62.74 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.06 0.457 . . . . 0.0 111.048 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.92 -24.92 23.47 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.148 0.499 . . . . 0.0 111.453 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.93 -51.61 66.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.281 0.562 . . . . 0.0 111.255 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 57.53 37.59 27.7 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.876 0.846 . . . . 0.0 110.724 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -140.06 -80.5 0.28 Allowed 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.843 -0.535 . . . . 0.0 110.461 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tt -68.2 -35.78 72.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 121.657 -0.652 . . . . 0.0 111.156 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -50.53 -33.41 21.52 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 121.982 -0.449 . . . . 0.0 111.716 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.72 -49.95 75.43 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -41.58 91.41 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 121.895 0.855 . . . . 0.0 109.591 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.22 -35.98 80.55 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -177.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -106.85 -26.31 11.3 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -79.57 -11.83 59.87 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.483 -0.761 . . . . 0.0 111.898 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.448 ' HA ' ' HB2' ' B' ' 685' ' ' PHE . 5.6 pt -60.66 -36.2 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.919 -0.488 . . . . 0.0 110.322 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -52.88 -47.35 67.93 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.29 -0.256 . . . . 0.0 110.682 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.66 -36.11 68.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.9 -29.39 68.32 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.967 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 14.4 mm -61.21 -45.72 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 O-C-N 121.79 -0.569 . . . . 0.0 109.614 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 64.7 mt -65.63 -42.5 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.86 -37.78 68.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.85 -48.88 86.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.76 -27.33 12.69 Favored Glycine 0 CA--C 1.541 1.693 0 O-C-N 121.691 -0.631 . . . . 0.0 112.054 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.1 m -60.65 -42.3 96.7 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . 0.413 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.33 -32.75 70.37 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.457 -0.777 . . . . 0.0 112.108 -177.3 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.413 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.86 -47.83 85.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 O-C-N 121.704 -0.622 . . . . 0.0 109.618 -178.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.36 -32.83 84.25 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -53.91 -36.43 62.72 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.287 1.042 . . . . 0.0 110.031 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 25.8 mmt180 -55.02 -27.63 45.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 124.104 0.961 . . . . 0.0 112.505 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . 0.408 HD12 HG21 ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.33 -36.1 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 O-C-N 120.832 -1.168 . . . . 0.0 108.844 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.7 p -64.51 -30.81 51.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.422 -0.799 . . . . 0.0 109.967 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.9 m-85 -56.65 -31.01 63.97 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.833 -0.542 . . . . 0.0 109.681 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.93 -37.52 76.89 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -41.57 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 176.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.9 tp -58.39 -39.12 78.8 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.825 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 50.2 m -64.07 -36.62 84.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.436 0.636 . . . . 0.0 109.813 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -43.28 99.19 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.28 1.038 . . . . 0.0 109.136 178.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 93.8 t -69.82 -45.47 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.717 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . 0.469 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 7.6 m-20 -62.92 -39.64 95.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.404 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -48.59 60.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 0.0 111.401 -177.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -42.55 34.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -176.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.53 -45.24 94.57 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' B' ' 706' ' ' ASN . 5.5 pt20 -104.84 -24.54 12.87 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 144.5 160.18 8.39 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -100.79 -70.64 0.73 Allowed 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.731 -0.864 . . . . 0.0 112.795 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 713' ' ' SER . . . . . 0.431 ' HA ' HG22 ' A' ' 708' ' ' VAL . 1.6 m -63.24 159.46 48.62 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.717 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 714' ' ' PRO . . . . . 0.411 ' C ' ' O ' ' B' ' 713' ' ' SER . 3.7 Cg_exo -28.44 108.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 122.651 2.234 . . . . 0.0 112.614 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 1.6 tt -75.94 -11.91 60.05 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 122.159 0.98 . . . . 0.0 111.942 -178.723 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 31.3 tp10 . . . . . 0 N--CA 1.464 0.249 0 CA-C-O 121.798 0.809 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -30.16 65.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.266 -178.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.0 -8.39 2.29 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -35.66 80.77 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.538 -0.726 . . . . 0.0 111.13 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -58.74 -42.39 88.67 Favored 'General case' 0 C--N 1.344 0.33 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -71.43 -35.56 70.98 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.834 177.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.2 m -57.1 -37.73 72.35 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.065 -0.397 . . . . 0.0 110.227 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.4 mp -55.68 -17.69 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.564 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.52 -29.66 68.04 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 12.7 tp -55.7 -18.54 8.32 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.082 0.468 . . . . 0.0 110.05 178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 42.5 t -55.69 -53.34 38.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.658 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -71.96 -18.87 61.96 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.795 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.16 -20.46 35.54 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.053 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 67.5 p -58.6 -38.14 77.34 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.849 -0.795 . . . . 0.0 109.408 179.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.84 -50.73 63.55 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.461 0.648 . . . . 0.0 109.62 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.84 -35.53 81.43 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.3 tt -59.84 -45.51 92.2 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.794 -0.567 . . . . 0.0 110.756 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.29 -37.78 80.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.652 0.739 . . . . 0.0 109.178 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.08 -30.31 68.6 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.342 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -55.58 -49.79 71.8 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.844 -1.16 . . . . 0.0 109.281 -179.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.67 -45.89 60.58 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.42 0.628 . . . . 0.0 112.45 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 -46.72 65.37 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 8.9 ttm-85 -64.26 -49.94 69.91 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -177.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 3.0 m -62.27 -43.56 98.55 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.999 -0.438 . . . . 0.0 111.684 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.89 -53.84 52.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 60.2 p -98.06 -49.24 4.83 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.396 0.617 . . . . 0.0 112.348 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 24.6 tp 69.15 102.92 0.06 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.867 0.842 . . . . 0.0 110.333 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 42.6 t80 64.6 -77.93 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.925 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 20.0 m -95.73 151.82 19.02 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.597 -0.689 . . . . 0.0 111.356 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.26 -30.88 43.28 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.864 0.364 . . . . 0.0 110.5 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -53.34 -40.44 64.9 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.92 0.867 . . . . 0.0 109.357 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.1 tpt85 -58.24 -29.49 65.79 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.578 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.95 -34.96 72.38 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -64.14 -35.03 79.46 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.98 -46.95 73.06 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 774' ' ' LEU . . . . . 0.417 ' O ' HG13 ' B' ' 777' ' ' ILE . 1.5 tt -63.25 -37.98 89.37 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.953 0.882 . . . . 0.0 110.264 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.97 -37.06 81.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.836 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.48 -44.86 63.95 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.931 -0.481 . . . . 0.0 111.688 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 777' ' ' ILE . . . . . 0.417 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.7 pp -64.5 -36.97 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.734 -0.604 . . . . 0.0 109.49 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 51.8 t -57.31 -46.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 O-C-N 121.678 -0.639 . . . . 0.0 111.028 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 5.8 t -63.5 -35.57 80.88 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.557 -0.714 . . . . 0.0 112.158 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -31.5 71.81 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.68 -0.638 . . . . 0.0 111.308 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 79.8 mt -60.42 -42.69 91.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.081 -0.387 . . . . 0.0 111.585 -178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 6.7 m -54.93 -38.81 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.334 -0.854 . . . . 0.0 110.061 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.32 -45.56 92.68 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.596 0.713 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 17.5 tp -66.12 -43.97 85.6 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.293 0.568 . . . . 0.0 111.078 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 4.2 tp -77.12 -16.47 59.16 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.074 0.464 . . . . 0.0 111.273 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.3 -48.11 15.91 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.88 106.99 19.38 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.524 -179.467 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 121.496 0.665 . . . . 0.0 109.286 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 6.8 mp 60.68 120.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.621 0.725 . . . . 0.0 111.555 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.55 169.21 3.13 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.426 0.631 . . . . 0.0 110.059 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.08 -52.07 66.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.763 0.792 . . . . 0.0 109.679 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.71 -17.15 61.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.853 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -81.07 -44.26 18.27 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.027 0.441 . . . . 0.0 111.189 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -63.95 -46.28 85.41 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.45 0.643 . . . . 0.0 110.284 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.48 -26.53 68.76 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.533 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -63.75 -37.97 89.37 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.047 0.451 . . . . 0.0 111.723 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.18 -34.78 74.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.869 0.366 . . . . 0.0 111.629 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -59.67 -21.96 61.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.036 0.446 . . . . 0.0 111.285 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -79.61 -24.54 41.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.173 0.511 . . . . 0.0 111.26 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -58.77 -37.63 76.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.507 0.67 . . . . 0.0 110.352 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 59.09 27.48 16.45 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.008 178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.71 -68.81 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.548 -0.72 . . . . 0.0 112.227 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -37.93 64.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.517 0.675 . . . . 0.0 111.083 -178.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.54 -33.84 47.36 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.958 -0.463 . . . . 0.0 111.149 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -62.95 -50.03 72.42 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.037 0.446 . . . . 0.0 110.343 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -65.69 -44.2 86.92 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.284 0.564 . . . . 0.0 109.801 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -35.76 82.01 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -95.51 -33.52 12.4 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -75.36 -16.37 60.39 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.788 -0.57 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 pp -60.54 -36.77 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.877 -0.514 . . . . 0.0 110.304 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -57.04 -47.34 81.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.216 0.531 . . . . 0.0 110.005 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.81 -35.73 75.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -32.03 70.26 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.867 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 9.6 mm -60.86 -49.51 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.327 0.584 . . . . 0.0 109.95 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -65.27 -36.94 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.8 -37.94 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 73.5 t -55.73 -39.99 58.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.18 -40.32 91.44 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 9.8 m -63.26 -39.41 94.53 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 122.167 0.984 . . . . 0.0 109.817 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -46.15 89.2 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.318 -177.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.85 -42.12 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.51 -32.28 77.4 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -58.22 -38.41 76.74 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.997 0.903 . . . . 0.0 109.645 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -55.95 -28.13 55.6 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 19.8 tt -58.06 -36.35 56.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 120.924 -1.11 . . . . 0.0 111.141 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 13.9 p -54.86 -29.51 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 121.402 -0.812 . . . . 0.0 109.375 176.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.43 -31.58 64.06 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.171 -0.956 . . . . 0.0 109.619 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.01 97.41 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 52.7 t -68.33 -36.24 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.698 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.82 -37.03 82.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.366 0.667 . . . . 0.0 109.773 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.6 m -62.19 -36.45 81.95 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.219 0.533 . . . . 0.0 110.518 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -41.35 97.91 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 122.153 0.977 . . . . 0.0 108.708 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.58 -44.53 93.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-O 122.176 0.988 . . . . 0.0 108.952 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.35 -35.88 80.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.333 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -49.69 75.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 121.685 -0.634 . . . . 0.0 110.532 -178.126 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -44.67 32.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.435 0.636 . . . . 0.0 111.766 -178.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -73.36 -39.85 64.84 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.377 -178.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -102.67 -18.89 15.0 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 102.31 171.11 27.08 Favored Glycine 0 CA--C 1.536 1.348 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.1 p90 -119.13 -54.29 2.22 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.681 -0.893 . . . . 0.0 112.297 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 87.6 p -94.44 159.42 33.84 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-O 118.752 -0.642 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -39.55 103.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.668 1.579 . . . . 0.0 111.749 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 715' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' C' ' 716' ' ' SER . 27.7 tp -85.81 -19.89 30.0 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 716' ' ' SER . . . . . 0.479 ' C ' ' O ' ' C' ' 715' ' ' LEU . 35.5 t . . . . . 0 N--CA 1.5 2.052 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.58 0.705 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -61.7 -33.26 73.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.346 0.593 . . . . 0.0 111.088 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -58.32 -38.23 76.7 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.113 0.482 . . . . 0.0 110.95 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -63.24 -42.67 99.23 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 122.175 -0.328 . . . . 0.0 111.153 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -58.03 -38.42 76.2 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.41 0.624 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -71.1 -42.54 69.17 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.375 0.607 . . . . 0.0 109.573 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.28 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.123 -0.361 . . . . 0.0 111.051 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.58 -21.0 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 120.039 -0.664 . . . . 0.0 109.717 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -59.67 -28.13 66.99 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.359 -0.838 . . . . 0.0 109.074 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.98 -24.49 39.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 53.8 t -55.59 -54.6 24.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -72.9 -26.76 61.54 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.094 0.95 . . . . 0.0 109.233 174.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.32 -20.83 38.12 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.241 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 74.7 m -60.51 -38.02 83.0 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.919 -0.754 . . . . 0.0 109.429 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.61 -50.1 54.12 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.352 0.596 . . . . 0.0 110.159 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.71 80.24 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -60.38 -45.46 93.46 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.311 0.577 . . . . 0.0 110.383 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 54.5 mt -65.62 -36.91 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.894 0.854 . . . . 0.0 108.717 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.22 -30.6 68.79 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.933 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -55.56 -46.01 77.22 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.571 -0.706 . . . . 0.0 110.244 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.25 -41.9 72.91 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.283 0.563 . . . . 0.0 110.987 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -33.34 75.5 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -81.95 -38.93 24.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -44.52 61.89 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.246 -0.909 . . . . 0.0 109.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.23 -53.66 45.63 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.502 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 46.6 t -97.81 -49.24 4.89 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.529 -0.732 . . . . 0.0 112.496 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.17 98.53 0.07 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 122.036 0.922 . . . . 0.0 110.914 -178.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 62.9 t80 48.88 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.417 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 20.3 t -73.9 154.01 39.59 Favored 'General case' 0 C--N 1.346 0.418 0 O-C-N 121.325 -0.859 . . . . 0.0 110.598 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.24 -19.46 58.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.93 0.395 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -43.72 88.37 Favored 'General case' 0 C--N 1.345 0.375 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.5 mmt-85 -58.73 -30.77 67.72 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.487 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.67 -32.6 71.79 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.08 0.467 . . . . 0.0 109.842 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.31 -37.78 70.39 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -63.98 -34.72 78.64 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 774' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.64 -38.68 78.62 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-O 121.074 0.464 . . . . 0.0 110.355 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.24 -43.25 92.39 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.564 0.697 . . . . 0.0 110.623 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 50.3 mt -74.34 -34.7 63.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.603 0.716 . . . . 0.0 110.182 178.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.03 -43.15 95.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.523 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 34.6 m -64.93 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.191 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -48.11 78.21 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.843 -0.535 . . . . 0.0 111.784 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -31.41 71.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.143 0.497 . . . . 0.0 111.769 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 21.2 mt -57.85 -36.88 57.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 782' ' ' VAL . . . . . 0.443 ' HA ' ' CD ' ' A' ' 747' ' ' ARG . 33.9 m -53.2 -37.77 28.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.518 0 CA-C-N 119.35 0.977 . . . . 0.0 110.94 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.6 -41.59 90.67 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.855 -0.528 . . . . 0.0 112.074 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 16.3 tp -70.15 -44.59 68.51 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -176.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 785' ' ' LEU . . . . . 0.595 HD22 ' HB3' ' A' ' 747' ' ' ARG . 3.4 tp -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.969 -1.082 . . . . 0.0 110.389 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -40.92 -48.06 4.17 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 116.442 -0.345 . . . . 0.0 112.451 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.35 100.07 10.5 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.808 0.813 . . . . 0.0 111.181 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.365 179.945 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.616 ' N ' HD23 ' C' ' 663' ' ' LEU . 1.4 mt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 69.0 mt 57.97 116.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.981 0.896 . . . . 0.0 112.117 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -176.63 175.04 1.76 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.532 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.425 ' C ' HD23 ' A' ' 663' ' ' LEU . 10.3 tt -50.67 -39.87 52.17 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.504 0.668 . . . . 0.0 110.837 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -74.37 -36.07 63.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.51 0.671 . . . . 0.0 111.7 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -43.21 78.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 111.301 -179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -67.16 -46.27 74.5 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.498 0.666 . . . . 0.0 110.242 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.59 -38.0 83.4 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.469 0.652 . . . . 0.0 110.758 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.8 m -60.41 -33.82 73.05 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.347 0.594 . . . . 0.0 111.115 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.0 tp -61.28 -25.52 67.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.87 0.367 . . . . 0.0 111.605 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -59.84 -25.87 65.35 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.766 -0.584 . . . . 0.0 110.799 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -64.12 -27.28 68.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.204 0.526 . . . . 0.0 111.15 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -59.68 -52.51 65.2 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.766 0.793 . . . . 0.0 110.215 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 26.1 t80 64.12 24.72 13.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.116 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -143.5 -61.93 0.4 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.67 -0.644 . . . . 0.0 111.338 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.7 tp -67.58 -37.68 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.395 0.617 . . . . 0.0 110.574 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -52.95 -34.24 54.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -67.33 -50.14 61.23 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.218 0.533 . . . . 0.0 111.31 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.554 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.6 OUTLIER -66.2 -43.35 87.0 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.425 0.631 . . . . 0.0 109.823 179.027 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.414 HD23 HG13 ' A' ' 675' ' ' ILE . 2.3 mm? -66.37 -35.91 81.53 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -99.58 8.37 44.5 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -176.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -120.24 -10.89 9.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.514 -0.742 . . . . 0.0 112.088 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.554 HG23 ' O ' ' A' ' 678' ' ' TRP . 6.8 pt -61.6 -35.73 68.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 121.867 -0.521 . . . . 0.0 110.527 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -47.29 68.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.036 -0.415 . . . . 0.0 110.765 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.455 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -68.86 -35.96 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.534 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.7 OUTLIER -59.96 -28.12 67.39 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.427 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.923 HD12 HG21 ' C' ' 686' ' ' ILE . 18.2 mm -60.79 -46.14 96.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.284 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 62.6 mt -64.67 -38.48 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.2 -37.19 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.3 t -54.55 -40.4 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.66 -39.37 85.94 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 177.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.3 m -66.66 -38.36 86.7 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.722 0.772 . . . . 0.0 109.413 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.39 -46.31 89.03 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.72 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.746 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.99 -40.56 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.439 -179.561 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.47 -24.2 61.37 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -38.2 82.76 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.88 0.848 . . . . 0.0 109.632 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.6 mmt180 -55.5 -28.17 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.486 0.715 . . . . 0.0 112.243 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.15 -39.42 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -177.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.76 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.63 -30.49 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 O-C-N 121.609 -0.682 . . . . 0.0 109.704 176.888 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -55.95 -29.06 59.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.92 0.39 . . . . 0.0 110.445 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.04 71.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.76 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -59.56 -35.85 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.025 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.73 -39.45 77.33 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 58.1 m -62.72 -38.29 89.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.581 0.705 . . . . 0.0 109.794 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -45.72 93.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.31 1.052 . . . . 0.0 108.571 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.53 HG22 HD12 ' A' ' 748' ' ' LEU . 93.3 t -62.35 -45.27 99.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.12 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 706' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 3.2 m120 -62.68 -38.45 90.44 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.244 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.656 HH21 HG23 ' A' ' 708' ' ' VAL . 4.5 tmm_? -62.61 -45.94 90.57 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.805 -0.559 . . . . 0.0 111.0 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.656 HG23 HH21 ' A' ' 707' ' ' ARG . 1.2 t -76.19 -42.01 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-O 122.233 1.016 . . . . 0.0 109.033 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -70.56 -18.93 62.92 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 710' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 18.6 tt0 -86.72 -13.47 45.25 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.499 0.666 . . . . 0.0 111.876 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 97.09 46.61 2.38 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.1 t80 52.18 -127.73 2.41 Favored 'General case' 0 CA--C 1.564 1.5 0 O-C-N 122.0 -0.706 . . . . 0.0 109.8 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 66.2 m -62.25 130.9 93.41 Favored Pre-proline 0 C--N 1.347 0.49 0 O-C-N 120.987 -1.071 . . . . 0.0 109.378 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.507 ' CG ' HD21 ' C' ' 748' ' ' LEU . 71.9 Cg_exo -43.59 106.62 0.08 OUTLIER 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 121.111 1.207 . . . . 0.0 111.922 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -99.61 -5.4 29.09 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.44 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 3.8 t . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 122.507 1.146 . . . . 0.0 109.18 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 121.872 0.844 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -57.74 -26.09 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.634 0.73 . . . . 0.0 110.739 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.8 -22.78 26.34 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.665 ' O ' HD12 ' A' ' 746' ' ' ILE . 5.8 mtm105 -65.63 -46.62 78.56 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.663 -0.648 . . . . 0.0 112.472 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -44.62 91.52 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.75 -0.594 . . . . 0.0 110.827 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -40.15 72.48 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.125 -0.36 . . . . 0.0 111.331 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 61.9 p -65.5 -33.46 75.98 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 122.203 -0.311 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.4 OUTLIER -63.17 -46.45 95.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.28 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.509 ' CD ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -62.09 -8.71 5.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.171 -1.412 . . . . 0.0 111.313 -177.733 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 705' ' ' VAL . 0.2 OUTLIER -55.73 -14.94 2.55 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.532 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 746' ' ' ILE 0.316 1.9 t -52.97 -54.59 16.06 Favored 'Isoleucine or valine' 0 C--N 1.35 0.595 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 176.385 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.48 ' ND2' ' NH2' ' A' ' 747' ' ' ARG . 7.1 m120 -73.36 -28.58 62.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.06 -1.427 . . . . 0.0 109.103 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.78 -19.9 30.57 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.035 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 78.6 p -57.93 -37.74 74.64 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 36.8 tp -62.1 -50.87 70.2 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.16 72.4 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.629 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.441 ' C ' HD23 ' A' ' 755' ' ' LEU . 9.9 tt -58.97 -44.05 91.48 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.62 -0.675 . . . . 0.0 110.768 -178.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.8 mt -61.56 -36.97 76.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.62 68.84 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.228 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.656 ' OD2' HD22 ' B' ' 715' ' ' LEU . 51.5 m-20 -55.58 -43.85 76.36 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.383 0.611 . . . . 0.0 109.805 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.46 -41.08 73.26 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 110.682 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.65 -33.54 76.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.711 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -77.42 -30.84 53.66 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 6.5 p -77.33 -45.25 26.73 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.359 -0.838 . . . . 0.0 110.342 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.462 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -68.12 -53.72 23.3 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -178.183 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 92.0 p -98.13 -49.15 4.84 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.538 -0.726 . . . . 0.0 112.69 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 17.4 tp 101.29 -87.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.318 1.447 . . . . 0.0 110.689 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -110.8 -70.68 0.8 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.468 -0.77 . . . . 0.0 110.976 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.4 t -87.25 158.74 19.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.201 0.524 . . . . 0.0 110.322 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -83.11 13.26 4.23 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.037 0.446 . . . . 0.0 111.529 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -98.93 -41.73 7.46 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.622 0.725 . . . . 0.0 109.321 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -56.04 -29.91 61.13 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.753 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -31.02 69.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.051 -0.406 . . . . 0.0 111.244 -177.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ptt85 -57.49 -40.18 78.07 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.612 0.72 . . . . 0.0 109.637 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.39 -42.98 74.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.048 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.3 tt -60.57 -38.42 84.5 Favored 'General case' 0 C--N 1.349 0.56 0 CA-C-O 121.438 0.637 . . . . 0.0 110.459 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -35.76 72.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.146 0.974 . . . . 0.0 109.328 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.95 -44.95 65.01 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.399 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.716 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -65.82 -37.3 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.91 -0.494 . . . . 0.0 111.056 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.716 ' N ' HD13 ' A' ' 777' ' ' ILE . 17.4 m -60.81 -46.54 96.0 Favored 'Isoleucine or valine' 0 C--N 1.35 0.588 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.271 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.78 ' O ' HG22 ' A' ' 782' ' ' VAL . 7.2 m -64.22 -36.91 85.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-O 121.824 0.821 . . . . 0.0 109.674 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 780' ' ' ARG . . . . . 0.442 ' HD3' HD13 ' A' ' 784' ' ' LEU . 2.2 ttt85 -65.58 -30.35 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.944 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.74 HG21 ' CG2' ' B' ' 746' ' ' ILE . 3.5 tp -53.49 -36.57 27.92 Favored 'Isoleucine or valine' 0 C--N 1.348 0.529 0 O-C-N 121.887 -0.508 . . . . 0.0 111.28 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 779' ' ' THR . 16.7 m -55.09 -38.11 45.19 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 C-N-CA 119.354 -0.939 . . . . 0.0 110.271 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -64.91 -46.58 81.11 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.509 0.671 . . . . 0.0 110.756 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.442 HD13 ' HD3' ' A' ' 780' ' ' ARG . 7.2 mp -64.47 -40.9 96.56 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.527 0.679 . . . . 0.0 111.39 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 59.4 tp . . . . . 0 CA--C 1.548 0.876 0 CA-C-O 121.102 0.477 . . . . 0.0 111.746 -179.235 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.435 HD12 ' N ' ' B' ' 660' ' ' LEU . 7.0 mp . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.561 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.0 mm? 60.92 116.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.313 0.577 . . . . 0.0 110.506 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -173.72 161.98 3.98 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.347 0.594 . . . . 0.0 109.64 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.538 HD11 HD13 ' C' ' 660' ' ' LEU . 9.4 tt -55.41 -43.99 75.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.656 0.741 . . . . 0.0 110.31 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.18 -28.62 67.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.376 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.0 tptt -75.57 -48.9 20.36 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.045 0.45 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.416 ' CE2' HD22 ' C' ' 661' ' ' LEU . 83.7 m95 -58.55 -45.99 87.77 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.616 0.722 . . . . 0.0 110.39 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.22 66.66 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.681 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 27.6 t -72.32 -26.82 62.09 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.987 0.422 . . . . 0.0 111.545 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.37 -39.16 92.26 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.964 -0.46 . . . . 0.0 111.602 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -59.73 -20.36 56.0 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.931 -0.481 . . . . 0.0 111.355 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -82.07 -24.43 35.26 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.292 0.568 . . . . 0.0 111.006 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -68.9 -47.27 66.22 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.511 0.672 . . . . 0.0 110.626 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 44.2 t80 58.28 32.17 21.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.68 0.752 . . . . 0.0 111.31 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -140.26 -70.83 0.38 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.815 -0.553 . . . . 0.0 110.662 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.15 -37.5 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 121.848 -0.532 . . . . 0.0 111.081 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -52.56 -35.46 53.81 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 24.7 m120 -62.83 -50.08 72.36 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.493 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.503 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.7 t90 -66.24 -43.77 85.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.982 0.896 . . . . 0.0 109.638 177.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.66 -35.72 78.75 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.127 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -94.79 -50.83 4.97 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -53.33 -18.2 2.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.802 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.9 pp -60.51 -36.65 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.759 -0.588 . . . . 0.0 110.544 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 683' ' ' ARG . . . . . 0.802 ' N ' HD12 ' B' ' 682' ' ' ILE . 14.1 ttt-85 -58.25 -47.46 83.49 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.908 -0.495 . . . . 0.0 110.93 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.477 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.04 -34.48 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -27.94 69.2 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.253 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.813 HD12 HG21 ' A' ' 686' ' ' ILE . 18.5 mm -60.7 -50.87 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.417 0.627 . . . . 0.0 110.213 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.68 -40.4 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.27 0.557 . . . . 0.0 109.524 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.52 -38.9 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.85 -48.12 90.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.51 -27.0 10.89 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.769 -0.582 . . . . 0.0 111.744 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 5.4 m -60.81 -45.27 95.09 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.619 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.26 -32.39 69.96 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.651 -0.656 . . . . 0.0 112.546 -176.61 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.619 ' H ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.88 -46.36 87.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 O-C-N 121.725 -0.609 . . . . 0.0 110.165 -178.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.98 -31.73 79.61 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.64 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.2 tt -57.66 -36.55 72.04 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.493 1.139 . . . . 0.0 110.389 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.746 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.5 mmt180 -55.59 -28.88 57.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -36.68 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.907 -1.121 . . . . 0.0 110.251 -176.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.64 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.36 -30.85 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.444 -0.785 . . . . 0.0 110.92 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -56.71 -31.42 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.857 -0.527 . . . . 0.0 110.404 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.4 80.37 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.51 -38.06 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.96 -37.68 88.47 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.157 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 59.6 p -64.06 -34.55 78.27 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.212 0.53 . . . . 0.0 110.743 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -43.12 94.73 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.129 0.966 . . . . 0.0 109.161 178.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' B' ' 748' ' ' LEU . 93.5 t -68.98 -44.92 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.15 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.54 -36.15 81.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -62.04 -50.03 73.63 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 122.071 0.939 . . . . 0.0 109.999 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.562 ' CG1' HD12 ' B' ' 748' ' ' LEU . 1.7 t -77.57 -44.07 29.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.921 -1.036 . . . . 0.0 113.239 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -57.79 -44.24 86.13 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 6.6 pt20 -103.79 -23.76 13.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.58 128.51 3.0 Favored Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -71.19 -60.55 2.17 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.75 152.28 90.59 Favored Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 121.152 -0.967 . . . . 0.0 110.58 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.461 ' HG3' HD23 ' A' ' 748' ' ' LEU . 69.4 Cg_exo -32.72 113.49 0.06 OUTLIER 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.563 2.176 . . . . 0.0 112.501 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.656 HD22 ' OD2' ' A' ' 758' ' ' ASP . 6.0 tt -77.3 -16.33 59.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 122.097 0.951 . . . . 0.0 112.126 -178.976 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 121.002 0.43 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -28.15 63.16 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.081 0.467 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.16 -7.12 3.66 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.692 HH11 HD11 ' A' ' 777' ' ' ILE . 8.2 ttp-105 -68.19 -40.25 82.28 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.806 -0.559 . . . . 0.0 111.623 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.11 -43.68 87.31 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.243 0.544 . . . . 0.0 109.715 -179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 744' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' B' ' 747' ' ' ARG . 0.0 OUTLIER -71.33 -39.33 71.45 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.188 178.085 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.6 p -56.94 -34.41 67.97 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 121.326 -0.858 . . . . 0.0 110.957 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.74 ' CG2' HG21 ' A' ' 781' ' ' ILE . 87.1 mt -52.88 -25.2 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.478 -0.773 . . . . 0.0 112.287 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 744' ' ' ARG . 0.0 OUTLIER -59.67 -28.48 67.31 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.783 1.629 . . . . 0.0 109.132 179.802 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.562 HD12 ' CG1' ' B' ' 708' ' ' VAL . 3.5 mt -55.9 -16.36 4.56 Favored 'General case' 0 C--N 1.353 0.741 0 O-C-N 121.75 -0.594 . . . . 0.0 110.696 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 31.8 t -56.54 -54.13 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 106.978 -1.489 . . . . 0.0 106.978 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -72.68 -16.37 61.69 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.473 175.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.19 -20.58 36.21 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.716 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 14.4 m -58.72 -37.93 77.2 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.999 0.9 . . . . 0.0 109.882 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.78 -51.05 37.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.483 0.658 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.92 76.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.232 0.539 . . . . 0.0 111.67 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 755' ' ' LEU . . . . . 0.525 ' C ' HD23 ' B' ' 755' ' ' LEU . 9.5 tt -59.12 -45.36 91.13 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.907 -0.496 . . . . 0.0 110.734 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.4 mt -66.08 -36.27 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 122.135 0.969 . . . . 0.0 108.844 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.12 -29.53 69.3 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.834 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -54.94 -48.21 73.45 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.586 -0.697 . . . . 0.0 109.466 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.92 -45.48 64.19 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.14 -46.43 74.09 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -64.9 -29.74 70.7 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.819 -0.55 . . . . 0.0 112.372 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 80.0 p -75.71 -45.47 36.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.543 0.687 . . . . 0.0 110.95 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.439 ' O ' HD13 ' B' ' 774' ' ' LEU . 2.0 mp -61.07 -54.77 40.64 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 13.7 p -98.71 -49.62 4.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.528 0.68 . . . . 0.0 112.678 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 12.8 tp 71.1 99.66 0.06 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.718 0.77 . . . . 0.0 110.47 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.89 -80.94 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.207 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 17.6 p -84.31 158.32 21.22 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.638 -0.664 . . . . 0.0 110.558 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 768' ' ' TYR . . . . . 0.516 ' CE2' HD13 ' B' ' 771' ' ' LEU . 18.3 t80 -89.52 -31.76 17.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.96 0.409 . . . . 0.0 110.902 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.26 -37.71 64.99 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.999 0.904 . . . . 0.0 109.199 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -56.22 -29.77 61.41 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.546 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' B' ' 768' ' ' TYR . 10.0 tt -59.65 -41.0 89.54 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.905 -0.497 . . . . 0.0 109.698 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -57.74 -42.91 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.94 -46.17 90.5 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.439 HD13 ' O ' ' B' ' 763' ' ' LEU . 0.8 OUTLIER -59.25 -37.77 78.41 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.741 0.782 . . . . 0.0 109.997 178.284 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.624 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.5 OUTLIER -58.07 -36.91 73.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.074 -178.423 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 49.5 mt -70.71 -48.34 55.09 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.585 -0.697 . . . . 0.0 111.364 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 18.4 pt -62.58 -36.12 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.899 0.38 . . . . 0.0 109.98 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.411 HG23 HG12 ' C' ' 746' ' ' ILE . 0.4 OUTLIER -54.81 -45.79 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.11 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.606 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -63.83 -36.03 82.56 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.641 0.734 . . . . 0.0 110.492 178.381 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -67.08 -37.88 84.75 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 64.1 mt -63.92 -41.59 93.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.999 -0.438 . . . . 0.0 111.266 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.606 HG22 ' O ' ' B' ' 779' ' ' THR . 6.8 m -58.14 -38.58 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 121.282 -0.886 . . . . 0.0 110.176 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -59.97 -42.08 93.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.725 0.774 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.59 -43.36 85.1 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.605 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.783 HD23 ' HB2' ' C' ' 750' ' ' ASN . 5.9 tp -82.36 -18.31 42.56 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 122.05 -0.406 . . . . 0.0 111.604 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -50.76 -42.94 46.76 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 118.89 36.62 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.759 -179.414 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.538 HD13 HD11 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.429 ' N ' HD12 ' C' ' 661' ' ' LEU . 8.3 mp 59.02 109.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.712 0.768 . . . . 0.0 110.807 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -173.11 165.74 4.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.488 0.661 . . . . 0.0 110.243 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.677 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -50.7 -55.74 15.14 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.486 0.66 . . . . 0.0 110.591 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.677 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.6 t70 -71.03 -19.66 62.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.538 . . . . 0.0 112.384 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -80.61 -44.71 18.48 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.074 -0.391 . . . . 0.0 111.187 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -64.64 -45.76 85.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.407 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.24 -19.3 65.78 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.936 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 15.7 p -72.17 -28.63 63.35 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.815 -0.553 . . . . 0.0 111.327 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.33 -38.66 87.7 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 122.106 -0.372 . . . . 0.0 111.621 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -59.58 -29.79 68.2 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.599 -0.688 . . . . 0.0 110.985 -178.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -63.94 -31.99 73.36 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.472 0.653 . . . . 0.0 110.624 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -63.31 -41.65 98.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.495 0.664 . . . . 0.0 110.371 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 52.18 36.75 20.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.542 0.687 . . . . 0.0 111.334 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -146.59 -72.0 0.23 Allowed 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.604 -0.685 . . . . 0.0 111.338 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' C' ' 678' ' ' TRP . 6.2 tp -67.78 -37.5 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.952 -0.468 . . . . 0.0 110.981 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -52.24 -34.69 47.16 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -66.06 -50.15 65.17 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.712 -0.618 . . . . 0.0 110.451 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.426 ' CE3' HD12 ' C' ' 675' ' ' ILE . 1.3 t90 -65.81 -43.85 87.4 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 121.617 0.722 . . . . 0.0 109.727 178.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.469 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -64.05 -35.89 82.22 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.98 -8.0 22.81 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -97.81 -11.66 23.06 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.378 -0.826 . . . . 0.0 112.927 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.91 -36.6 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 O-C-N 121.744 -0.597 . . . . 0.0 110.499 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.517 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.8 ttt-85 -54.09 -47.42 71.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.776 0.322 . . . . 0.0 111.1 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.467 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.2 mp -68.81 -35.95 71.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.79 -32.37 70.55 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.92 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.923 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.61 -44.34 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.35 -41.62 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.88 -37.69 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.475 ' O ' HG23 ' C' ' 693' ' ' ILE . 94.0 t -54.95 -39.8 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.22 -42.52 82.44 Favored Glycine 0 C--N 1.346 1.137 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.4 -38.7 90.74 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.991 0.9 . . . . 0.0 109.021 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 tp -59.87 -43.99 94.42 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.083 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.475 HG23 ' O ' ' C' ' 689' ' ' VAL . 1.2 pp -65.63 -41.86 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.979 -0.45 . . . . 0.0 109.91 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -64.25 -27.74 71.99 Favored Glycine 0 CA--C 1.537 1.429 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.604 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -60.86 -39.46 89.25 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.877 0.846 . . . . 0.0 110.113 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.25 -29.17 60.72 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.744 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.1 OUTLIER -59.26 -36.21 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -176.68 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.604 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.3 p -54.38 -30.6 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.317 -0.864 . . . . 0.0 110.631 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -56.45 -31.32 63.86 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.999 -0.438 . . . . 0.0 110.281 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.72 79.0 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 177.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -43.44 92.8 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 122.07 0.938 . . . . 0.0 108.565 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.9 -37.67 87.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.403 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.3 m -62.76 -39.17 93.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.196 0.522 . . . . 0.0 110.343 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.494 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.7 OUTLIER -62.12 -44.98 95.46 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.21 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.62 -45.16 99.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.85 0.833 . . . . 0.0 108.892 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -62.6 -37.0 84.54 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.373 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.31 -49.78 71.29 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -36.02 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.36 0.6 . . . . 0.0 111.95 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -70.36 -44.25 68.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.04 -21.49 13.92 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.01 178.54 17.8 Favored Glycine 0 CA--C 1.537 1.448 0 N-CA-C 110.194 -1.162 . . . . 0.0 110.194 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -132.9 -54.42 0.93 Allowed 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.896 -0.767 . . . . 0.0 112.328 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.448 ' HA ' HG21 ' B' ' 708' ' ' VAL . 1.7 m -71.66 142.0 85.62 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-O 118.776 -0.63 . . . . 0.0 109.309 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -30.06 96.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 123.101 2.534 . . . . 0.0 113.195 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.48 18.5 2.25 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.492 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.838 0.827 . . . . 0.0 109.647 -179.115 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.997 0.904 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -69.19 -26.47 64.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.143 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -64.71 -36.99 86.08 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.472 ' O ' HD12 ' C' ' 746' ' ' ILE . 42.6 ptt85 -74.34 -38.57 63.22 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.27 -37.47 75.05 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.941 -1.099 . . . . 0.0 109.337 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -71.43 -37.04 71.48 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.885 0.374 . . . . 0.0 110.475 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 18.9 p -67.94 -35.28 78.15 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.831 -0.543 . . . . 0.0 111.243 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.472 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -59.5 -22.2 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -59.47 -30.05 68.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.507 HD21 ' CG ' ' A' ' 714' ' ' PRO . 0.2 OUTLIER -61.74 -16.35 48.58 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.539 178.747 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 44.5 t -55.53 -54.47 25.2 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.783 ' HB2' HD23 ' B' ' 785' ' ' LEU . 4.2 m120 -72.53 -24.64 61.17 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 122.223 1.011 . . . . 0.0 108.547 174.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -20.13 32.54 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.996 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 42.7 m -58.44 -40.71 83.32 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 117.546 0.673 . . . . 0.0 109.332 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 22.6 tp -62.85 -51.14 68.16 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 754' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -58.91 -34.4 71.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.713 0.768 . . . . 0.0 111.28 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.478 ' C ' HD23 ' C' ' 755' ' ' LEU . 10.0 tt -58.56 -45.25 89.35 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.489 -176.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 756' ' ' ILE . . . . . 0.431 HG22 HD12 ' C' ' 760' ' ' LEU . 2.3 mp -69.73 -29.54 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.68 -31.64 69.8 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -55.43 -47.17 76.38 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.937 -1.102 . . . . 0.0 109.622 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.59 -45.27 65.67 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 760' ' ' LEU . . . . . 0.431 HD12 HG22 ' C' ' 756' ' ' ILE . 14.0 mt -66.32 -45.98 78.47 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -66.61 -49.64 65.66 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 23.0 p -67.51 -40.89 85.14 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.68 -0.637 . . . . 0.0 111.042 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -54.47 15.97 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.4 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -97.75 -49.37 4.85 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.304 -0.873 . . . . 0.0 112.331 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 6.5 tp 78.17 83.62 0.07 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 122.088 0.947 . . . . 0.0 111.042 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.17 -81.01 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.389 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 16.8 p -86.5 165.97 15.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.529 -0.732 . . . . 0.0 111.683 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -28.52 29.46 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -52.88 -37.16 60.14 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.964 0.888 . . . . 0.0 108.932 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 71.4 mmt-85 -69.31 -30.9 69.06 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.628 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.4 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.6 tt -60.97 -35.35 76.56 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.738 -0.601 . . . . 0.0 109.961 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -57.34 -35.18 69.58 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -63.06 -42.08 99.6 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.663 HD13 HG22 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -63.25 -38.52 91.47 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-O 122.057 0.932 . . . . 0.0 109.104 177.868 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.465 ' O ' HG22 ' C' ' 778' ' ' VAL . 0.2 OUTLIER -58.11 -43.18 87.02 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.737 -0.602 . . . . 0.0 110.036 -179.396 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.13 -35.58 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.337 0.589 . . . . 0.0 110.737 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.663 HG22 HD13 ' C' ' 774' ' ' LEU . 2.7 tt -65.17 -37.59 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.158 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.659 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -63.39 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.323 -0.861 . . . . 0.0 110.642 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.801 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.6 m -64.42 -48.72 74.28 Favored 'General case' 0 C--N 1.344 0.331 0 O-C-N 121.833 -0.542 . . . . 0.0 112.085 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -31.56 71.74 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.389 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 19.6 mt -54.96 -36.15 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 122.215 -0.303 . . . . 0.0 110.649 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.801 HG22 ' O ' ' C' ' 779' ' ' THR . 23.0 m -52.87 -38.09 27.48 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 O-C-N 121.256 -0.902 . . . . 0.0 110.944 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.333 0.587 . . . . 0.0 111.188 178.8 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.489 ' CB ' HD23 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.689 0.757 . . . . 0.0 109.128 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 33.4 mt 59.52 106.75 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.978 0.894 . . . . 0.0 110.797 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 179.41 -178.62 0.37 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.18 -46.04 86.46 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 121.363 -0.836 . . . . 0.0 109.696 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.9 -33.02 73.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.463 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 -49.05 11.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 111.007 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -64.8 -40.72 95.7 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 110.685 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.12 62.58 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.703 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -29.98 64.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.17 0.51 . . . . 0.0 111.001 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -59.78 -36.78 77.38 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.057 -0.402 . . . . 0.0 110.898 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -59.71 -17.4 34.33 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.884 0.373 . . . . 0.0 111.384 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.68 -29.02 21.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.334 0.588 . . . . 0.0 110.661 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -59.9 -48.97 79.51 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.681 0.753 . . . . 0.0 110.576 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 60.25 40.03 18.39 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.892 0.853 . . . . 0.0 110.58 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -71.06 0.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.923 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.403 HD12 ' CE3' ' A' ' 678' ' ' TRP . 6.9 tp -68.25 -37.51 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 121.957 -0.464 . . . . 0.0 111.326 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.15 -35.73 49.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -64.71 -50.14 68.14 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.376 0.608 . . . . 0.0 110.568 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.568 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.7 t90 -65.53 -43.05 91.21 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.675 0.75 . . . . 0.0 109.997 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -35.62 81.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -102.82 -3.15 26.76 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -109.37 -5.61 15.77 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.346 0.975 . . . . 0.0 112.729 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 678' ' ' TRP . 10.7 pt -68.48 -36.13 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 110.779 179.155 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -53.26 -41.73 65.79 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.254 0.549 . . . . 0.0 110.047 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.478 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -76.8 -34.96 23.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 177.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.481 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.4 t80 -59.84 -38.93 83.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.169 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.671 HG21 HD12 ' B' ' 686' ' ' ILE . 1.4 mp -60.6 -45.58 97.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 86.3 mt -61.73 -39.55 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.481 HD12 ' HA ' ' A' ' 685' ' ' PHE . 94.5 mt -59.85 -37.73 73.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.982 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 693' ' ' ILE . 93.3 t -54.85 -40.04 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.49 83.48 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 16.4 m -62.14 -38.68 89.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.04 0.924 . . . . 0.0 109.606 177.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.29 -39.33 86.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.923 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.667 HG22 HG21 ' C' ' 693' ' ' ILE . 0.9 OUTLIER -65.7 -43.17 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-O 121.153 0.501 . . . . 0.0 110.39 -178.278 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.12 92.96 Favored Glycine 0 CA--C 1.535 1.321 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.1 tt -53.5 -38.7 63.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 122.278 1.037 . . . . 0.0 110.045 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -57.02 -28.82 62.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.091 0.956 . . . . 0.0 112.362 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 40.7 mt -59.51 -36.54 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 O-C-N 121.502 -0.749 . . . . 0.0 110.438 -176.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.797 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.5 p -66.49 -30.51 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.468 -0.77 . . . . 0.0 110.763 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -55.59 -28.53 55.61 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.547 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.4 -36.9 71.89 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.797 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.8 m -61.17 -36.6 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.533 -0.729 . . . . 0.0 109.578 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.9 tp -57.62 -37.64 73.61 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.995 -0.44 . . . . 0.0 110.429 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 16.0 m -62.24 -40.49 96.35 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.442 0.639 . . . . 0.0 109.997 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.426 HD13 HH22 ' A' ' 707' ' ' ARG . 0.4 OUTLIER -60.59 -43.17 97.68 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.527 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.449 HG22 HD12 ' A' ' 748' ' ' LEU . 78.4 t -64.71 -45.01 96.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 CA-C-O 121.858 0.837 . . . . 0.0 109.101 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.84 -36.2 80.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.876 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.426 HH22 HD13 ' A' ' 704' ' ' LEU . 2.1 tmm_? -65.71 -49.52 68.2 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.22 0.534 . . . . 0.0 111.668 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.423 HG23 ' NH2' ' A' ' 707' ' ' ARG . 1.0 OUTLIER -76.32 -44.06 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.921 0.867 . . . . 0.0 110.279 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -63.37 -22.09 66.67 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 710' ' ' GLN . . . . . 0.449 ' NE2' HD21 ' C' ' 755' ' ' LEU . 2.4 mt-30 -92.85 -21.77 19.68 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.181 -0.949 . . . . 0.0 112.114 -178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 111.79 35.42 1.86 Allowed Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 71.97 -171.93 0.15 Allowed 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.28 1.038 . . . . 0.0 111.502 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 3.7 m -62.46 161.25 27.65 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.499 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -12.51 92.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 124.56 3.507 . . . . 0.0 115.692 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -106.83 -17.16 14.28 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.919 -179.533 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 78.8 p . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 122.292 1.044 . . . . 0.0 110.932 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-O 121.922 0.868 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -26.1 65.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.296 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -55.79 -6.79 0.24 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.22 -41.54 88.87 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.273 -0.892 . . . . 0.0 109.757 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.614 ' HA ' HD13 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -67.04 -45.19 78.2 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.143 0.497 . . . . 0.0 110.442 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -30.86 71.32 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.275 0.559 . . . . 0.0 110.651 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 13.1 p -67.53 -46.56 72.47 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.621 HG21 HD12 ' C' ' 781' ' ' ILE . 1.5 mt -61.46 -47.0 95.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.803 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.641 ' NE ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.91 -7.55 11.9 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 117.844 -1.543 . . . . 0.0 111.278 -177.465 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.475 HD23 ' HG3' ' B' ' 714' ' ' PRO . 0.2 OUTLIER -60.21 -14.82 19.61 Favored 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 171.092 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.454 HG12 ' OD1' ' A' ' 750' ' ' ASN 0.291 1.6 t -53.06 -55.15 13.57 Favored 'Isoleucine or valine' 0 C--N 1.356 0.884 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 177.294 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.458 ' ND2' ' NH1' ' A' ' 747' ' ' ARG . 7.6 m120 -73.32 -27.64 61.64 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.924 174.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.81 -19.59 29.56 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 89.0 p -57.49 -37.28 72.69 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.86 -48.09 82.11 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.66 -34.88 71.73 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.011 0.434 . . . . 0.0 110.54 177.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.85 -45.07 90.95 Favored 'General case' 0 C--N 1.345 0.397 0 O-C-N 121.981 -0.449 . . . . 0.0 111.412 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.54 -33.08 55.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.16 -30.14 68.31 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.374 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.472 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.0 m-20 -55.16 -45.75 75.7 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.43 -0.794 . . . . 0.0 109.846 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.94 -44.35 69.75 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.473 0.654 . . . . 0.0 111.237 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -37.48 87.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -67.51 -44.56 78.15 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.245 0.545 . . . . 0.0 111.796 -178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.6 t -64.88 -45.18 87.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.962 0.887 . . . . 0.0 111.499 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.686 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -64.58 -54.15 36.58 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -177.786 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 764' ' ' SER . . . . . 0.462 ' OG ' HD12 ' A' ' 771' ' ' LEU . 1.4 m -98.45 -22.99 15.74 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 8.9 tp 77.07 -60.53 0.46 Allowed 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.733 -0.604 . . . . 0.0 109.886 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.96 -67.72 0.29 Allowed 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.019 -0.425 . . . . 0.0 111.108 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.0 m -93.27 155.07 17.65 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.036 0.446 . . . . 0.0 110.531 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.97 -40.27 94.74 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.029 0.442 . . . . 0.0 110.323 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -53.94 -39.22 65.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.885 0.85 . . . . 0.0 109.664 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -58.47 -29.87 66.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.777 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.525 HD11 HD23 ' A' ' 763' ' ' LEU . 10.5 tt -59.56 -36.1 75.54 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 109.964 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -57.14 -33.34 67.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.484 0.659 . . . . 0.0 109.524 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -62.83 -42.36 99.7 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.817 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 763' ' ' LEU . 11.4 tp -58.83 -38.36 78.5 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 121.181 0.515 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.95 -39.83 93.44 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.158 0.504 . . . . 0.0 111.895 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 776' ' ' LEU . . . . . 0.544 ' O ' HG22 ' A' ' 779' ' ' THR . 39.6 mt -75.11 -42.16 57.02 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.81 -0.556 . . . . 0.0 112.395 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.555 HD11 HD12 ' A' ' 774' ' ' LEU . 1.1 pt -68.78 -37.51 77.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.731 -178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 774' ' ' LEU . 27.5 m -58.48 -42.65 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.543 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.688 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.9 t -63.57 -35.38 80.31 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 121.59 -0.694 . . . . 0.0 111.292 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.91 73.14 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.017 0.437 . . . . 0.0 111.692 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.437 ' CB ' HG21 ' B' ' 746' ' ' ILE . 24.4 mm -57.23 -41.97 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.996 -0.44 . . . . 0.0 111.439 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.688 HG22 ' O ' ' A' ' 779' ' ' THR . 10.4 m -54.95 -38.82 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.741 -0.6 . . . . 0.0 110.702 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -59.87 -48.84 80.07 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.327 0.584 . . . . 0.0 111.086 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.18 -43.37 70.92 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.391 0 O-C-N 121.906 -0.496 . . . . 0.0 111.161 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.583 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.7 mm? 52.29 83.47 0.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.875 0.845 . . . . 0.0 110.539 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -150.79 157.81 43.39 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.685 0.755 . . . . 0.0 110.555 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.498 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.7 OUTLIER -47.0 -57.69 4.75 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 122.283 1.039 . . . . 0.0 111.559 -179.729 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.498 ' N ' HD23 ' B' ' 663' ' ' LEU . 12.3 m-20 -64.33 -28.92 70.04 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.437 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -71.62 -49.43 40.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.03 0.443 . . . . 0.0 110.401 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -61.95 -46.63 88.44 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.355 0.597 . . . . 0.0 110.518 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.36 -21.49 66.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.7 t -70.67 -32.9 70.34 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 111.038 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 669' ' ' LEU . 4.4 mm? -60.46 -31.53 70.52 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.402 0.62 . . . . 0.0 111.087 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -59.61 -21.11 59.93 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.185 0.516 . . . . 0.0 111.321 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -86.8 -26.8 23.92 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.16 0.505 . . . . 0.0 111.216 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -60.13 -48.44 81.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.419 0.628 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.2 t80 59.82 40.86 18.91 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 122.027 0.917 . . . . 0.0 110.817 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.61 -72.05 0.2 Allowed 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.856 -0.528 . . . . 0.0 110.687 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -68.42 -37.22 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 O-C-N 121.961 -0.462 . . . . 0.0 111.303 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -52.36 -33.96 45.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -69.02 -50.14 51.43 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.604 -0.685 . . . . 0.0 110.875 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.728 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.4 t90 -65.76 -44.26 86.4 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.824 0.821 . . . . 0.0 109.126 178.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.17 -35.89 81.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -95.9 -21.0 18.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -95.95 -5.27 41.72 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.285 -0.885 . . . . 0.0 112.17 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.728 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.3 pt -62.59 -36.65 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.721 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -53.04 -47.36 68.47 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.979 0.419 . . . . 0.0 110.62 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.474 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -66.57 -35.33 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.51 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.34 -31.12 70.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.957 179.475 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.671 HD12 HG21 ' A' ' 686' ' ' ILE . 19.2 mm -60.8 -44.72 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 109.856 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.34 -41.07 88.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.305 0.574 . . . . 0.0 109.502 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.11 -38.79 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 685' ' ' PHE . 54.0 t -57.63 -39.71 71.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 690' ' ' GLY . . . . . 0.429 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -64.64 -26.77 71.18 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.4 m -60.62 -46.6 89.66 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.587 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.91 -33.34 71.74 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -176.521 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.587 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.84 -41.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 -178.697 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.584 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.67 -34.3 88.08 Favored Glycine 0 CA--C 1.537 1.413 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.602 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.0 tt -59.72 -37.04 77.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.224 1.012 . . . . 0.0 110.506 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -55.93 -28.54 57.3 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.584 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.4 tt -58.63 -36.08 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 O-C-N 121.169 -0.957 . . . . 0.0 110.696 -176.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -54.52 -30.26 21.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 O-C-N 121.859 -0.526 . . . . 0.0 110.899 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -55.98 -30.0 61.1 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.729 -0.607 . . . . 0.0 110.389 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.42 -40.81 83.49 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.455 HG22 ' O ' ' B' ' 698' ' ' VAL . 1.3 m -69.35 -35.99 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tp -51.65 -37.76 51.81 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.815 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 43.0 m -62.82 -38.82 92.25 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.751 0.786 . . . . 0.0 109.948 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.454 HD22 ' NH1' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -62.13 -43.15 99.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.429 1.109 . . . . 0.0 108.801 178.603 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.581 HG22 HD11 ' B' ' 748' ' ' LEU . 57.6 t -67.67 -40.64 84.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.695 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' B' ' 710' ' ' GLN . 7.9 m-20 -62.4 -37.61 86.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.028 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.454 ' NH1' HD22 ' B' ' 704' ' ' LEU . 11.1 mtm105 -68.13 -44.31 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.152 0.977 . . . . 0.0 111.273 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.55 -45.35 33.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -65.88 -45.84 80.57 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 118.877 -1.129 . . . . 0.0 112.96 -175.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 0.9 OUTLIER -105.57 -24.16 12.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 -179.372 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.95 164.03 10.94 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -102.49 -61.58 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.5 p -65.55 158.81 72.01 Favored Pre-proline 0 N--CA 1.468 0.427 0 O-C-N 121.316 -0.865 . . . . 0.0 109.637 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.475 ' HG3' HD23 ' A' ' 748' ' ' LEU . 87.3 Cg_exo -29.32 118.59 0.05 OUTLIER 'Trans proline' 0 N--CA 1.496 1.676 0 C-N-CA 122.784 2.323 . . . . 0.0 112.981 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 758' ' ' ASP . 5.0 tt -83.65 -19.01 36.14 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 122.535 1.159 . . . . 0.0 111.282 -178.844 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 122.082 0.944 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 42.1 mtp85 -72.59 -25.87 61.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.254 -0.884 . . . . 0.0 113.201 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.13 -9.38 0.39 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -176.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 1.4 mtm105 -60.45 -37.62 81.54 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.406 -0.809 . . . . 0.0 110.175 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.22 -29.85 66.03 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.043 0.449 . . . . 0.0 109.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -49.39 43.44 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 121.532 0.682 . . . . 0.0 109.647 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -59.85 -33.92 72.44 Favored 'General case' 0 N--CA 1.46 0.068 0 O-C-N 122.026 -0.422 . . . . 0.0 110.214 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.437 HG21 ' CB ' ' A' ' 781' ' ' ILE . 1.5 mp -58.07 -22.02 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 31.8 ttt-85 -59.58 -17.32 31.89 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.581 HD11 HG22 ' B' ' 705' ' ' VAL . 7.2 tt -55.03 -27.04 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 749' ' ' VAL . . . . . 0.421 HG23 ' O ' ' B' ' 746' ' ' ILE . 94.7 t -55.05 -53.82 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -72.66 -24.32 61.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.331 -1.304 . . . . 0.0 109.837 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.54 37.81 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.242 -178.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 24.7 m -59.43 -38.7 81.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 117.857 0.828 . . . . 0.0 109.656 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 26.0 tp -69.54 -47.13 64.71 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.49 0.662 . . . . 0.0 110.179 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.59 -35.44 77.37 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 755' ' ' LEU . . . . . 0.494 HD22 ' O ' ' B' ' 755' ' ' LEU . 1.7 tm? -59.51 -45.34 92.0 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.06 -0.4 . . . . 0.0 111.665 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.76 -36.81 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 121.377 0.608 . . . . 0.0 110.011 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.97 -30.59 69.05 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.483 ' OD2' HD23 ' C' ' 715' ' ' LEU . 85.7 m-20 -55.91 -49.75 72.59 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.04 -1.038 . . . . 0.0 109.934 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -70.8 -42.56 70.14 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.31 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.6 -45.98 70.54 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -65.36 -20.48 66.41 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 762' ' ' SER . . . . . 0.472 ' O ' HD22 ' B' ' 774' ' ' LEU . 1.6 m -76.6 -45.64 29.37 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.768 -0.582 . . . . 0.0 111.326 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -54.87 14.42 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 5.3 t -98.97 -49.83 4.39 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.855 0.836 . . . . 0.0 112.294 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.3 tt 63.86 89.34 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.825 0.822 . . . . 0.0 109.384 -177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 13.1 t80 72.74 122.11 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.514 0.673 . . . . 0.0 111.222 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.0 m 57.82 164.26 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.316 0.579 . . . . 0.0 111.451 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -109.84 64.31 0.61 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.781 1.277 . . . . 0.0 110.395 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.25 -42.51 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 122.474 1.13 . . . . 0.0 108.115 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -55.94 -29.03 59.5 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.527 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.738 ' O ' HD23 ' B' ' 771' ' ' LEU . 6.4 tt -59.38 -31.09 68.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.247 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -43.02 99.59 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -68.99 -45.2 71.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.634 . . . . 0.0 109.807 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.507 HD21 ' CZ ' ' C' ' 742' ' ' ARG . 0.1 OUTLIER -60.34 -37.87 81.98 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.752 0.787 . . . . 0.0 109.998 178.834 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.686 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.7 tm? -58.03 -36.8 73.24 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.673 -0.642 . . . . 0.0 110.007 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.4 mt -71.78 -38.22 70.33 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.103 -0.373 . . . . 0.0 111.884 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 777' ' ' ILE . . . . . 0.5 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.4 pp -69.4 -37.45 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.52 -0.738 . . . . 0.0 109.877 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 83.5 t -60.53 -46.6 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.42 -0.8 . . . . 0.0 110.012 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.793 ' O ' HG22 ' B' ' 782' ' ' VAL . 2.6 t -63.85 -41.11 97.88 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.852 -0.53 . . . . 0.0 112.413 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.63 72.08 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.716 -0.615 . . . . 0.0 111.91 -178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.8 mt -57.88 -37.03 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 O-C-N 121.78 -0.575 . . . . 0.0 111.049 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 779' ' ' THR . 16.1 m -54.49 -38.14 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.301 -0.875 . . . . 0.0 110.012 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -64.33 -44.61 90.99 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.342 0.592 . . . . 0.0 110.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.08 -42.12 80.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.467 0.651 . . . . 0.0 111.253 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.408 HD23 ' CG ' ' C' ' 750' ' ' ASN . 8.2 tp -76.98 -20.29 56.27 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.245 0.545 . . . . 0.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -55.84 -28.21 52.12 Favored Glycine 0 CA--C 1.534 1.229 0 O-C-N 122.005 -0.435 . . . . 0.0 112.107 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.17 128.24 54.53 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.809 -0.818 . . . . 0.0 110.633 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.454 179.524 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.792 0.806 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.6 142.9 11.24 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -173.2 176.0 3.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.443 0.639 . . . . 0.0 110.975 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.489 HD23 ' CB ' ' A' ' 660' ' ' LEU . 2.5 tm? -52.94 -46.54 68.18 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 122.036 0.922 . . . . 0.0 110.943 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -64.53 -26.62 68.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.58 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -81.14 -42.38 20.99 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 110.412 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -60.71 -44.79 96.16 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.583 0.706 . . . . 0.0 110.613 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.71 -26.65 64.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.208 0.528 . . . . 0.0 111.646 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.4 t -61.33 -30.32 70.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.98 -0.45 . . . . 0.0 112.07 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.488 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.7 mm? -66.7 -39.51 88.11 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -59.8 -27.65 66.77 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.649 -0.657 . . . . 0.0 111.091 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -66.3 -32.86 74.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.292 0.567 . . . . 0.0 110.129 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -63.87 -40.93 97.7 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.792 0.806 . . . . 0.0 109.637 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.1 t80 62.16 12.24 4.93 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.978 0.732 . . . . 0.0 112.978 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -136.72 -59.94 0.71 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.566 -0.709 . . . . 0.0 112.592 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -63.41 -38.23 81.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.504 0.668 . . . . 0.0 110.731 -178.525 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.8 m -52.84 -38.57 61.61 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.173 0.511 . . . . 0.0 110.967 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -59.34 -49.05 79.3 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.622 0.725 . . . . 0.0 109.933 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.504 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -60.19 -43.4 95.92 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.167 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.21 -40.05 90.05 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -94.87 -10.04 32.5 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -94.6 -22.9 17.88 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.714 -0.616 . . . . 0.0 111.933 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.504 HG23 ' O ' ' C' ' 678' ' ' TRP . 13.4 pt -64.51 -36.9 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.93 -0.481 . . . . 0.0 110.738 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 7.5 ttt-85 -54.47 -47.22 73.22 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.488 ' O ' HD13 ' C' ' 688' ' ' ILE . 1.8 mp -64.67 -34.48 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.7 OUTLIER -60.34 -37.27 80.12 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.737 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.601 HD12 HG22 ' B' ' 686' ' ' ILE . 10.9 mm -61.08 -47.19 94.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.103 0.478 . . . . 0.0 109.749 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.04 -37.06 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.488 HD13 ' O ' ' C' ' 684' ' ' ILE . 1.2 mp -58.93 -38.87 75.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 65.4 t -58.55 -40.12 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.74 -36.29 65.17 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 12.1 m -67.31 -38.94 85.77 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.47 1.128 . . . . 0.0 110.222 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -46.49 89.16 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.425 -1.261 . . . . 0.0 114.053 -176.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.667 HG21 HG22 ' A' ' 693' ' ' ILE . 2.2 pp -59.91 -41.58 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 O-C-N 121.82 -0.55 . . . . 0.0 110.761 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.688 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.17 -37.06 92.33 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.97 -37.35 66.39 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.545 0.688 . . . . 0.0 109.955 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.552 HH22 HD12 ' B' ' 697' ' ' ILE . 25.4 mmt180 -56.71 -30.54 63.6 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.999 -0.438 . . . . 0.0 111.695 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.688 HG22 ' O ' ' C' ' 694' ' ' GLY . 13.4 tt -60.98 -36.89 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.8 t -67.13 -30.7 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.635 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -62.05 -30.99 71.36 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.108 0.48 . . . . 0.0 110.115 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.75 76.43 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -63.0 -39.71 86.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -37.98 87.46 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.677 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.0 m -62.82 -37.84 88.33 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.819 -0.551 . . . . 0.0 110.285 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.96 -41.71 98.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.813 0.816 . . . . 0.0 108.807 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.582 HG13 HD13 ' C' ' 748' ' ' LEU . 48.2 t -62.72 -44.67 99.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.266 1.031 . . . . 0.0 108.475 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -60.16 -35.6 75.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.117 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -47.95 83.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.707 0.765 . . . . 0.0 110.826 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -41.28 41.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.768 0.794 . . . . 0.0 110.769 -178.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -73.19 -33.6 65.51 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.684 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -102.29 -15.77 16.49 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 103.7 -173.06 21.54 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -132.22 -53.44 0.97 Allowed 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.544 -0.974 . . . . 0.0 112.749 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 8.4 m -93.94 146.5 31.78 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-O 118.28 -0.867 . . . . 0.0 109.641 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -31.31 93.56 0.01 OUTLIER 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.623 2.215 . . . . 0.0 112.811 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.483 HD23 ' OD2' ' B' ' 758' ' ' ASP . 17.2 tp -73.68 -10.42 59.67 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 716' ' ' SER . . . . . 0.439 ' C ' ' O ' ' C' ' 715' ' ' LEU . 14.2 t . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 121.19 0.519 . . . . 0.0 112.29 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -26.43 62.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.51 -47.85 82.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.507 ' CZ ' HD21 ' B' ' 774' ' ' LEU . 24.3 ttp85 -63.88 -36.83 85.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -58.73 -34.14 71.01 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.029 1.286 . . . . 0.0 109.268 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -71.22 -32.73 69.14 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.489 0.662 . . . . 0.0 109.655 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 5.0 p -66.5 -47.31 73.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.92 0.39 . . . . 0.0 110.078 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.0 mp -53.98 -41.07 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 O-C-N 121.404 -0.81 . . . . 0.0 110.737 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -60.99 -16.13 39.61 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 118.372 -1.331 . . . . 0.0 110.417 -178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.582 HD13 HG13 ' C' ' 705' ' ' VAL . 0.9 OUTLIER -63.27 -19.26 64.41 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.362 176.804 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.0 t -55.21 -54.03 28.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.725 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.408 ' CG ' HD23 ' B' ' 785' ' ' LEU . 6.2 m120 -72.53 -27.12 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.816 174.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.67 37.46 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.53 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 97.8 p -58.69 -38.82 79.07 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.038 -0.684 . . . . 0.0 109.356 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 20.8 tp -67.07 -49.02 66.46 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 754' ' ' ALA . . . . . 0.46 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.45 -35.42 74.02 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.644 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.532 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.9 tm? -59.65 -45.34 92.31 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.837 -0.539 . . . . 0.0 110.706 -178.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.35 -41.39 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.478 0.656 . . . . 0.0 109.266 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -68.4 -30.86 69.87 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.11 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -55.65 -49.48 72.77 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.347 -0.846 . . . . 0.0 110.009 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -71.12 -45.02 64.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.493 0.663 . . . . 0.0 111.049 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.44 -44.15 96.09 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -74.46 -47.5 33.11 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -177.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 79.3 p -67.34 -43.75 80.75 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.85 0.833 . . . . 0.0 111.196 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.417 ' HG ' HD22 ' C' ' 774' ' ' LEU . 8.7 tt -59.73 -53.22 60.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.636 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 34.3 m -96.79 -13.43 22.62 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 9.0 mt 57.27 67.69 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.954 0.883 . . . . 0.0 110.717 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 59.3 t80 79.07 -89.62 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 61.8 m -93.78 171.79 8.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.305 -0.872 . . . . 0.0 111.986 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.28 -33.61 67.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.224 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -54.4 -35.08 62.49 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.019 0.914 . . . . 0.0 108.812 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.25 -30.17 64.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.798 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -60.06 -35.13 74.47 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -33.9 67.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -41.36 98.85 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.486 HD11 HD11 ' A' ' 746' ' ' ILE . 6.7 tp -59.35 -38.98 81.76 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-O 121.142 0.496 . . . . 0.0 109.717 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.477 ' O ' HG12 ' C' ' 778' ' ' VAL . 1.8 mm? -58.91 -42.55 89.92 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.365 0.602 . . . . 0.0 110.729 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 35.8 mt -74.52 -37.21 63.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 109.668 178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.626 ' O ' HG13 ' C' ' 781' ' ' ILE . 71.4 mt -61.39 -49.06 86.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.123 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.477 HG12 ' O ' ' C' ' 775' ' ' LEU . 7.5 p -54.76 -39.18 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.753 ' O ' HG22 ' C' ' 782' ' ' VAL . 8.3 m -63.61 -43.16 97.69 Favored 'General case' 0 C--N 1.335 -0.052 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.679 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -31.86 72.02 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.626 HG13 ' O ' ' C' ' 777' ' ' ILE . 11.5 mt -56.48 -36.27 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.838 -0.539 . . . . 0.0 110.968 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.753 HG22 ' O ' ' C' ' 779' ' ' THR . 18.0 m -52.47 -37.86 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 121.432 -0.792 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 CA--C 1.553 1.07 0 O-C-N 121.452 -0.78 . . . . 0.0 111.465 -179.924 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.553 ' HB2' HD21 ' C' ' 663' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 120.312 0.101 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.7 mt 170.25 119.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.505 -0.747 . . . . 0.0 109.576 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.06 -174.16 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.73 -0.606 . . . . 0.0 109.881 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.547 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.6 OUTLIER -54.34 -40.07 67.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.562 0.696 . . . . 0.0 109.855 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 664' ' ' ASP . . . . . 0.434 ' N ' HD23 ' A' ' 663' ' ' LEU . 0.6 OUTLIER -69.8 -34.74 74.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.779 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -73.53 -44.58 57.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.44 0.638 . . . . 0.0 110.657 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -72.8 -46.26 54.17 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.185 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.97 -30.58 70.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.084 0.469 . . . . 0.0 111.658 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.0 m -65.22 -32.34 73.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.255 0.55 . . . . 0.0 111.005 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.7 -30.57 71.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.861 0.362 . . . . 0.0 111.565 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -59.45 -24.46 63.55 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.708 -0.62 . . . . 0.0 111.195 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -73.3 -22.34 60.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.085 0.469 . . . . 0.0 111.265 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.9 m95 -64.48 -45.28 88.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-O 121.154 0.502 . . . . 0.0 111.171 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 673' ' ' PHE . . . . . 0.427 ' CG ' ' O ' ' A' ' 673' ' ' PHE . 49.3 t80 60.67 10.03 2.43 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.394 0.616 . . . . 0.0 111.027 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -123.9 -66.94 0.96 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.988 -1.07 . . . . 0.0 111.269 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.98 -37.67 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 122.059 -0.401 . . . . 0.0 111.392 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.5 m -52.7 -38.6 60.93 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -61.79 -50.07 73.83 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 121.271 0.558 . . . . 0.0 110.433 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.61 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.3 t90 -65.52 -39.35 91.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.78 0.8 . . . . 0.0 109.654 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -35.93 81.83 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -104.98 -20.01 13.66 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -84.75 -14.46 48.19 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.282 -0.886 . . . . 0.0 111.84 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.61 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.0 pt -60.82 -35.8 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.243 0.544 . . . . 0.0 110.513 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 -53.06 -47.02 68.77 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.151 -0.343 . . . . 0.0 110.346 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -65.96 -32.01 56.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -62.79 -29.86 71.03 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.158 179.684 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.805 HD12 HG21 ' C' ' 686' ' ' ILE . 21.2 mm -60.72 -45.4 97.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.16 0.505 . . . . 0.0 110.188 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.8 mt -71.12 -37.65 67.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.138 0.494 . . . . 0.0 109.776 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.02 -37.66 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 122.053 -0.404 . . . . 0.0 110.174 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 685' ' ' PHE . 67.4 t -54.61 -39.91 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 690' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -58.87 -38.77 93.0 Favored Glycine 0 CA--C 1.533 1.178 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.0 m -64.46 -38.3 90.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.815 0.817 . . . . 0.0 109.63 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -45.5 91.48 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.772 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.638 HG13 HG22 ' B' ' 693' ' ' ILE . 0.2 OUTLIER -67.38 -40.96 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.721 -179.2 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 694' ' ' GLY . . . . . 0.487 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -60.78 -21.62 58.64 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 177.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.517 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -62.53 -37.61 86.77 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.813 0.816 . . . . 0.0 109.788 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 3.0 mmt180 -55.02 -28.4 51.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 694' ' ' GLY . 20.4 tt -59.2 -36.79 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 O-C-N 120.559 -1.338 . . . . 0.0 109.427 -177.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.745 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -67.38 -30.92 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-O 121.514 0.673 . . . . 0.0 110.038 177.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.2 m-85 -55.61 -28.53 55.72 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.334 0.588 . . . . 0.0 109.733 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.0 -36.91 70.95 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.745 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -62.19 -35.72 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 O-C-N 121.59 -0.694 . . . . 0.0 109.485 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.6 -39.21 87.31 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.029 -0.419 . . . . 0.0 110.205 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -62.62 -33.82 75.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.512 0.672 . . . . 0.0 109.854 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.1 OUTLIER -62.9 -43.13 99.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.402 1.096 . . . . 0.0 108.745 177.972 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.825 HG22 HD23 ' A' ' 748' ' ' LEU . 67.1 t -67.77 -45.21 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.201 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.42 -37.08 84.43 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.512 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.431 ' CZ ' ' HE ' ' B' ' 707' ' ' ARG . 34.4 ttm180 -60.19 -49.46 77.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.894 0.854 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -43.05 49.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.001 0.905 . . . . 0.0 109.423 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.1 -14.59 61.88 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -98.41 7.68 45.87 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.011 -1.056 . . . . 0.0 113.427 -178.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 81.38 12.33 82.17 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.886 -0.509 . . . . 0.0 112.374 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.411 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.6 OUTLIER 61.94 -123.24 0.76 Allowed 'General case' 0 CA--C 1.564 1.492 0 O-C-N 121.648 -0.913 . . . . 0.0 110.774 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.411 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 13.4 p -62.22 159.1 41.78 Favored Pre-proline 0 C--N 1.355 0.832 0 O-C-N 120.732 -1.23 . . . . 0.0 110.625 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.413 ' HG3' ' HG ' ' C' ' 748' ' ' LEU . 84.8 Cg_exo -44.59 109.04 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.68 1.587 . . . . 0.0 112.836 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.22 -19.1 13.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.512 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 14.4 p . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 122.565 1.174 . . . . 0.0 110.427 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.838 0.828 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -25.62 62.65 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.71 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.54 -13.28 0.91 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 69.3 mtm-85 -69.19 -46.68 66.86 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.458 -0.777 . . . . 0.0 109.255 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.77 -41.46 86.67 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.746 0.784 . . . . 0.0 110.267 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -35.47 76.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.444 -0.785 . . . . 0.0 111.192 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.33 -38.39 81.49 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.07 -0.394 . . . . 0.0 111.793 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.762 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.5 mp -64.2 -47.1 91.38 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.258 0 CA-C-O 116.566 -1.683 . . . . 0.0 113.923 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.411 ' C ' ' N ' ' A' ' 749' ' ' VAL . 0.2 OUTLIER -64.78 -11.22 34.36 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 122.471 2.396 . . . . 0.0 110.644 -176.931 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.825 HD23 HG22 ' A' ' 705' ' ' VAL . 57.5 tp -56.15 -14.93 3.05 Favored 'General case' 0 CA--C 1.562 1.429 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.273 1.5 t -53.75 -54.17 21.37 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.608 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -72.36 -28.87 63.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 122.566 1.174 . . . . 0.0 108.289 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.661 ' HA3' HD12 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.32 Favored Glycine 0 C--N 1.339 0.726 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.181 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 79.8 p -57.36 -37.32 72.41 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.51 -47.49 85.38 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.13 -35.8 76.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.764 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.475 ' O ' HD23 ' A' ' 755' ' ' LEU . 6.7 tt -62.24 -45.34 93.76 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.292 0.568 . . . . 0.0 110.275 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 756' ' ' ILE . . . . . 0.412 HG22 HD12 ' A' ' 760' ' ' LEU . 52.8 mt -61.29 -36.88 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -69.45 -30.81 68.81 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.236 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.562 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 79.2 m-20 -57.9 -49.22 77.47 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.614 -0.679 . . . . 0.0 109.938 -178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -70.8 -43.42 68.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.019 0.528 . . . . 0.0 112.256 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.412 HD12 HG22 ' A' ' 756' ' ' ILE . 10.6 mt -68.73 -46.28 69.32 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 121.595 0.712 . . . . 0.0 112.565 -178.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -63.23 -25.4 68.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.292 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 61.6 p -74.3 -45.15 49.42 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.572 -0.705 . . . . 0.0 111.158 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.775 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -67.33 -55.52 13.49 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.092 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.43 -49.14 4.53 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.709 0.766 . . . . 0.0 112.173 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.476 ' C ' HD23 ' A' ' 765' ' ' LEU . 5.4 tt 82.98 -78.18 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.875 0.87 . . . . 0.0 111.644 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -109.99 -70.65 0.8 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.624 -0.672 . . . . 0.0 111.568 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.9 m -97.86 144.41 27.47 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.142 0.496 . . . . 0.0 110.604 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CE1' HD22 ' A' ' 771' ' ' LEU . 15.6 t80 -60.98 -29.54 69.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.997 0.427 . . . . 0.0 110.419 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -55.94 -36.65 68.0 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.882 0.849 . . . . 0.0 109.226 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.91 -29.6 60.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.671 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.69 HD11 HD23 ' A' ' 763' ' ' LEU . 29.5 tp -59.65 -43.53 93.87 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -59.53 -40.04 85.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.574 0.702 . . . . 0.0 109.394 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -68.0 -45.37 74.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.83 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 763' ' ' LEU . 0.2 OUTLIER -63.16 -38.41 91.05 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.392 0.615 . . . . 0.0 110.707 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.33 -39.88 88.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.9 -0.5 . . . . 0.0 111.168 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.9 mt -67.19 -40.64 86.55 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 17.8 pt -60.26 -36.93 71.69 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.56 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 35.2 t -55.59 -46.41 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.774 -0.579 . . . . 0.0 109.597 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.804 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.2 OUTLIER -63.92 -41.53 97.63 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.188 0.518 . . . . 0.0 110.856 179.358 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.87 72.49 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.44 -36.75 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 O-C-N 121.714 -0.616 . . . . 0.0 111.078 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 779' ' ' THR . 13.4 m -54.73 -40.26 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 O-C-N 121.471 -0.768 . . . . 0.0 111.46 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -65.28 -42.0 93.6 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.68 0.753 . . . . 0.0 111.178 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.9 tp -69.15 -38.79 78.95 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.327 0.584 . . . . 0.0 111.035 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.547 HD11 ' HG3' ' B' ' 747' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 120.871 0.367 . . . . 0.0 111.312 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.547 ' N ' HD12 ' A' ' 663' ' ' LEU . 3.0 tt . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.557 0.694 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.9 mp 61.02 103.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.575 0.702 . . . . 0.0 110.556 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -167.11 175.16 7.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.511 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.82 HD12 HD23 ' C' ' 660' ' ' LEU . 8.9 tt -53.59 -41.41 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.549 0.69 . . . . 0.0 110.363 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -73.31 -31.46 64.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.68 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -46.78 50.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.347 0.594 . . . . 0.0 110.777 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -64.38 -46.28 84.05 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.589 0.709 . . . . 0.0 110.394 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.37 -24.43 67.64 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.4 t -63.18 -35.01 78.89 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.229 0.537 . . . . 0.0 110.923 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.449 HD12 HG23 ' B' ' 675' ' ' ILE . 4.2 mm? -59.84 -28.12 67.22 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.211 0.529 . . . . 0.0 111.233 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -62.23 -23.53 66.71 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.048 0.452 . . . . 0.0 111.379 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -88.04 -26.6 22.49 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.238 0.542 . . . . 0.0 111.512 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -59.16 -49.11 79.12 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 111.014 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 59.3 41.34 20.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.799 0.809 . . . . 0.0 110.644 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -153.64 -71.33 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.802 -0.561 . . . . 0.0 111.224 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.465 HG13 HD23 ' B' ' 679' ' ' LEU . 6.5 tp -65.68 -37.21 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 O-C-N 121.869 -0.519 . . . . 0.0 111.344 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.26 -33.72 43.02 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -64.01 -49.88 70.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.439 0.638 . . . . 0.0 110.116 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.484 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.0 t90 -65.68 -39.86 91.75 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.828 0.823 . . . . 0.0 109.622 178.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.465 HD23 HG13 ' B' ' 675' ' ' ILE . 0.6 OUTLIER -66.12 -35.6 80.92 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.033 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -102.02 -31.2 10.77 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -68.81 -27.01 65.47 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.514 -0.741 . . . . 0.0 111.481 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.735 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.7 pp -60.42 -36.08 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 O-C-N 122.091 -0.381 . . . . 0.0 110.889 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 683' ' ' ARG . . . . . 0.735 ' N ' HD12 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -53.64 -47.23 70.51 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.281 0.563 . . . . 0.0 110.044 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.522 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.0 mp -76.06 -36.95 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -28.58 67.49 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.43 -44.78 96.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.54 -43.76 98.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.29 -37.86 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.433 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.407 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 42.4 t -55.81 -39.44 56.23 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -63.63 -27.46 71.02 Favored Glycine 0 CA--C 1.543 1.842 0 O-C-N 121.766 -0.584 . . . . 0.0 112.273 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 46.6 m -60.55 -44.55 96.0 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.624 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.43 -31.55 69.39 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 121.597 -0.69 . . . . 0.0 112.068 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.638 HG22 HG13 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -57.16 -44.69 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 O-C-N 121.438 -0.789 . . . . 0.0 109.237 -177.785 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.04 -32.07 80.94 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.442 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -55.54 -36.86 67.23 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.785 0.803 . . . . 0.0 109.89 178.866 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.1 mmt180 -54.67 -27.68 41.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.728 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.17 -36.02 55.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 O-C-N 120.85 -1.156 . . . . 0.0 109.325 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.442 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.0 p -61.78 -30.5 48.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 O-C-N 121.218 -0.926 . . . . 0.0 110.424 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 11.6 m-85 -56.62 -31.41 64.28 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.708 -0.62 . . . . 0.0 110.429 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.34 88.06 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.17 -38.78 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.13 -39.95 91.94 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.363 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -68.37 -33.59 74.54 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.579 0.704 . . . . 0.0 110.01 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -42.78 93.09 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.158 0.98 . . . . 0.0 108.956 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.16 -45.13 77.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 122.153 0.977 . . . . 0.0 109.176 178.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.53 -36.59 83.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.336 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.431 ' HE ' ' CZ ' ' A' ' 707' ' ' ARG . 18.3 ttm180 -62.07 -47.12 86.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.25 1.024 . . . . 0.0 109.485 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.6 t -70.28 -44.4 77.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.038 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.47 -44.97 95.34 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.562 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.4 pt20 -104.46 -24.46 13.04 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.11 176.18 14.35 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' A' ' 704' ' ' LEU . 0.9 OUTLIER -96.03 -65.05 1.0 Allowed 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.727 -0.867 . . . . 0.0 111.596 -179.224 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 42.9 p -69.48 159.61 82.82 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.353 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.594 ' HG3' HD13 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -31.63 142.3 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.361 2.041 . . . . 0.0 113.152 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.479 ' O ' HD23 ' B' ' 715' ' ' LEU . 8.3 tt -95.2 -18.9 20.5 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 715' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 122.326 1.06 . . . . 0.0 112.505 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.464 0.65 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -57.99 -26.32 62.2 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.332 0.587 . . . . 0.0 112.369 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -52.34 63.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.62 ' NH2' HD11 ' A' ' 774' ' ' LEU . 9.9 ptt85 -77.72 -34.47 52.66 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -45.06 90.6 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.093 -1.004 . . . . 0.0 108.809 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -71.46 -34.05 69.87 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.283 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 4.3 p -57.28 -38.29 73.7 Favored 'General case' 0 C--N 1.344 0.342 0 O-C-N 122.075 -0.391 . . . . 0.0 110.601 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.412 ' O ' HG23 ' B' ' 749' ' ' VAL . 28.5 mt -54.1 -19.87 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.553 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.547 ' HG3' HD11 ' A' ' 785' ' ' LEU . 3.0 ttt85 -59.85 -29.68 68.45 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.69 -18.67 8.57 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 122.109 -0.37 . . . . 0.0 110.063 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 749' ' ' VAL . . . . . 0.412 HG23 ' O ' ' B' ' 746' ' ' ILE . 43.9 t -56.04 -54.53 26.09 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 177.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -73.07 -22.11 60.66 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.27 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.9 -19.84 31.21 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.228 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 6.9 m -58.25 -37.47 74.99 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.799 -0.824 . . . . 0.0 108.968 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.4 tp -66.01 -51.02 62.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.299 0.571 . . . . 0.0 109.757 178.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.37 -36.38 83.83 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.96 -45.0 94.07 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.854 -0.529 . . . . 0.0 111.005 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -65.14 -34.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.711 0.767 . . . . 0.0 109.032 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.5 -30.29 68.11 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.724 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.402 ' OD1' HD22 ' C' ' 715' ' ' LEU . 37.9 m-20 -55.33 -47.96 74.89 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.323 -0.861 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.35 -45.25 66.49 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.105 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.4 mt -66.73 -46.5 75.28 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 761' ' ' ARG . . . . . 0.407 ' O ' ' HA ' ' B' ' 765' ' ' LEU . 26.5 mtm180 -66.65 -22.76 66.1 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 11.8 t -76.82 -45.1 29.9 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.521 0.677 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.856 ' HA ' HD22 ' B' ' 774' ' ' LEU . 5.1 mp -66.77 -54.6 21.11 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -178.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 764' ' ' SER . . . . . 0.554 ' C ' HD12 ' B' ' 765' ' ' LEU . 12.9 p -98.56 -23.39 15.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 765' ' ' LEU . . . . . 0.554 HD12 ' C ' ' B' ' 764' ' ' SER . 5.2 mp 70.37 -66.9 0.26 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 121.731 -0.606 . . . . 0.0 110.996 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -130.22 -67.06 0.75 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.783 -0.573 . . . . 0.0 110.997 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 7.3 m -97.66 146.44 25.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.332 0.587 . . . . 0.0 110.739 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.98 -31.96 70.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.939 0.4 . . . . 0.0 110.599 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -53.67 -39.08 64.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.822 0.82 . . . . 0.0 109.542 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.57 -29.65 64.62 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.279 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.432 ' O ' HD23 ' B' ' 771' ' ' LEU . 5.7 tt -59.5 -43.26 93.38 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -37.27 75.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.67 -48.74 75.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.856 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.1 OUTLIER -58.83 -38.12 77.95 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 121.82 0.819 . . . . 0.0 110.05 178.926 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.693 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -58.28 -36.66 73.62 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 121.784 -0.573 . . . . 0.0 110.507 -179.096 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 776' ' ' LEU . . . . . 0.42 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.32 -31.28 67.23 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 22.5 pt -70.27 -36.69 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 121.471 -0.768 . . . . 0.0 109.792 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 39.2 t -55.53 -46.04 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 121.666 -0.646 . . . . 0.0 111.15 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.42 HG22 ' O ' ' B' ' 776' ' ' LEU . 12.4 t -63.31 -42.67 99.04 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.997 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -37.41 81.54 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.573 -0.705 . . . . 0.0 111.15 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.92 -47.14 94.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 122.05 -0.406 . . . . 0.0 111.32 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.1 -38.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.488 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.17 -46.03 89.45 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.721 0.772 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 31.2 tp -68.7 -40.55 79.98 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.975 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.465 HD23 ' CG ' ' C' ' 750' ' ' ASN . 1.3 tp -78.01 -16.79 57.8 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.98 0.419 . . . . 0.0 111.787 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -49.3 -37.46 24.76 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 -106.12 122.55 46.41 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 122.179 -0.601 . . . . 0.0 110.641 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.67 -179.747 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.82 HD23 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.418 0.628 . . . . 0.0 109.578 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.0 mp -132.13 158.19 42.3 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.391 0.615 . . . . 0.0 111.056 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.66 166.04 2.13 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.664 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.5 tm? -58.37 -48.52 80.35 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.924 0.869 . . . . 0.0 110.089 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.22 -21.82 66.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.52 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -41.44 22.0 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -61.63 -46.45 89.75 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.533 0.682 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.82 -31.91 68.9 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.616 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -57.87 -38.13 75.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.47 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -61.31 -29.31 69.8 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.066 0.46 . . . . 0.0 111.764 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 41.7 m95 -59.53 -28.87 67.46 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.965 -0.46 . . . . 0.0 111.198 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -77.68 -25.1 49.27 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 122.013 -0.43 . . . . 0.0 111.748 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.22 -42.22 90.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.426 0.631 . . . . 0.0 110.579 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.2 t80 53.58 30.97 11.63 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.098 0.475 . . . . 0.0 111.833 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -151.46 -69.85 0.17 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.508 -0.745 . . . . 0.0 112.471 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.62 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -68.31 -37.19 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.474 0.654 . . . . 0.0 111.515 -178.844 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -51.93 -33.72 38.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.462 -178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -57.08 -49.02 77.14 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.628 0.727 . . . . 0.0 109.576 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.604 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.8 t90 -64.78 -44.22 90.68 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 122.004 -0.435 . . . . 0.0 110.416 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.15 -36.1 82.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -98.11 -15.42 19.97 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -98.44 -11.92 21.87 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.329 -0.857 . . . . 0.0 112.295 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.604 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.1 pt -61.06 -36.4 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 121.788 -0.57 . . . . 0.0 110.872 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -53.45 -47.32 69.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.962 0.41 . . . . 0.0 110.132 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.453 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.9 -34.05 67.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.488 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.79 -33.37 71.63 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.335 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.805 HG21 HD12 ' A' ' 686' ' ' ILE . 11.6 mm -60.64 -46.74 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.31 -39.55 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.8 -37.12 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.429 HG23 ' O ' ' C' ' 685' ' ' PHE . 78.4 t -54.38 -39.74 45.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.2 -38.98 80.04 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.3 m -67.41 -38.47 84.68 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 122.237 1.018 . . . . 0.0 109.421 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.0 tp -59.74 -46.17 89.95 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.261 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -67.84 -41.61 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.044 -0.41 . . . . 0.0 111.105 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.692 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.34 -29.85 69.91 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.597 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.4 tt -63.01 -37.6 87.83 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 122.005 0.907 . . . . 0.0 110.25 178.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -55.75 -28.4 55.74 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.692 HG22 ' O ' ' C' ' 694' ' ' GLY . 20.2 tt -58.61 -35.51 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.426 -0.796 . . . . 0.0 111.532 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.597 HG12 ' O ' ' C' ' 695' ' ' LEU . 11.0 p -53.97 -29.94 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.469 -0.769 . . . . 0.0 110.103 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -55.99 -31.5 63.09 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.808 -0.558 . . . . 0.0 110.336 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.47 -37.68 78.84 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.13 -39.28 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.87 -37.22 86.0 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.022 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 52.6 p -62.9 -36.14 82.39 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.761 -0.587 . . . . 0.0 110.621 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -40.49 93.94 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 108.832 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.27 -43.75 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -62.38 -35.66 79.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.364 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -59.52 -51.03 71.61 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.969 0.89 . . . . 0.0 110.355 -178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -45.56 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.925 0.869 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -73.81 -38.09 64.69 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -102.63 -2.52 28.19 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 86.45 -176.13 48.03 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -139.19 -57.96 0.6 Allowed 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.585 -0.95 . . . . 0.0 112.548 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 14.9 p -81.41 149.17 64.63 Favored Pre-proline 0 C--N 1.338 0.103 0 CA-C-O 118.335 -0.84 . . . . 0.0 109.644 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -30.64 94.64 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.429 2.086 . . . . 0.0 112.566 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.402 HD22 ' OD1' ' B' ' 758' ' ' ASP . 0.5 OUTLIER -81.52 16.78 1.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.305 -176.752 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 121.806 0.812 . . . . 0.0 110.34 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 121.66 0.743 . . . . 0.0 111.546 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -72.14 -26.68 62.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.848 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -61.56 -8.26 4.16 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.855 -0.528 . . . . 0.0 112.395 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.542 ' NE ' HD11 ' B' ' 774' ' ' LEU . 63.7 mtm-85 -71.76 -45.27 62.21 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.724 -0.61 . . . . 0.0 111.677 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.4 -38.62 77.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.877 -0.515 . . . . 0.0 109.796 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.12 -42.47 69.18 Favored 'General case' 0 N--CA 1.457 -0.084 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.2 p -58.35 -43.09 88.17 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 122.088 -0.383 . . . . 0.0 110.935 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.3 -21.03 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 O-C-N 121.667 -0.645 . . . . 0.0 109.448 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -59.74 -26.3 65.54 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 109.097 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.482 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.0 OUTLIER -55.5 -24.25 30.48 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.861 0.362 . . . . 0.0 110.104 178.553 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.66 -54.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.35 0.627 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.465 ' CG ' HD23 ' B' ' 785' ' ' LEU . 6.7 m120 -72.3 -24.93 61.4 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.892 0.853 . . . . 0.0 109.19 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.33 -20.75 37.89 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.905 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 1.9 m -58.81 -37.92 77.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.921 0.86 . . . . 0.0 109.775 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 19.1 tp -67.04 -51.42 55.0 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.479 0.657 . . . . 0.0 109.935 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 754' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.93 -34.84 78.88 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.413 0.625 . . . . 0.0 111.828 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.36 -45.11 92.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.101 0.477 . . . . 0.0 110.867 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.04 -34.83 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.517 0.675 . . . . 0.0 109.427 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.26 -30.76 68.94 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -55.76 -49.07 74.11 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 121.033 -1.042 . . . . 0.0 109.987 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -70.47 -44.77 67.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.448 0.642 . . . . 0.0 111.648 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -40.92 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -78.85 -35.57 43.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 15.4 p -64.54 -45.39 87.38 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.628 -0.67 . . . . 0.0 111.276 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -55.79 10.85 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.1 m -99.28 -49.53 4.43 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.419 -0.801 . . . . 0.0 112.67 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 8.7 tp 80.31 106.26 0.07 Allowed 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.884 0.849 . . . . 0.0 110.348 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 70.65 -68.26 0.22 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.64 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 3.3 m -144.47 179.66 7.12 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.356 0.598 . . . . 0.0 111.518 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.5 -162.32 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 11.1 t60 75.78 -59.81 0.51 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -61.96 -30.2 70.76 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.568 177.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.77 -32.59 70.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -35.09 68.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -69.45 -34.47 74.46 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.579 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.3 OUTLIER -58.74 -38.04 77.52 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.004 178.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.99 -37.01 73.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.648 0.737 . . . . 0.0 109.666 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.12 -38.99 60.88 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.643 0.735 . . . . 0.0 109.584 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.566 HG22 ' CD1' ' C' ' 781' ' ' ILE . 82.7 mt -59.06 -45.47 92.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.853 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 31.1 m -58.54 -44.11 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.313 -0.867 . . . . 0.0 111.42 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.419 ' O ' HG22 ' C' ' 782' ' ' VAL . 82.3 p -63.89 -46.19 85.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -31.76 72.11 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.133 0.492 . . . . 0.0 111.576 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.762 HG21 ' HB ' ' A' ' 746' ' ' ILE . 58.7 mt -63.89 -47.1 92.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.24 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.419 HG22 ' O ' ' C' ' 779' ' ' THR . 33.1 m -54.09 -37.89 36.46 Favored 'Isoleucine or valine' 0 C--N 1.35 0.625 0 CA-C-N 119.72 1.145 . . . . 0.0 110.047 -177.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 . . . . . 0 CA--C 1.543 0.677 0 CA-C-O 121.413 0.625 . . . . 0.0 110.767 178.494 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt -177.08 101.52 0.05 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.543 0.687 . . . . 0.0 109.676 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -173.65 -169.17 0.48 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.165 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.4 tt -48.02 -39.53 20.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.379 0.609 . . . . 0.0 110.821 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.48 -37.08 71.34 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -41.73 51.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.558 0.694 . . . . 0.0 110.739 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -75.15 -45.76 38.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.842 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.17 -35.28 76.13 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.021 0.439 . . . . 0.0 111.907 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.0 m -64.17 -31.03 72.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.526 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.418 HD23 HG23 ' A' ' 676' ' ' THR . 12.4 tp -63.42 -31.14 72.22 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.977 -0.452 . . . . 0.0 111.698 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -59.73 -29.84 68.41 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.778 -0.576 . . . . 0.0 111.08 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -25.57 68.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.183 0.516 . . . . 0.0 111.168 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -60.99 -40.54 93.86 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.59 0.71 . . . . 0.0 110.278 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 23.8 t80 56.34 35.01 25.15 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.559 0.695 . . . . 0.0 111.235 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -155.41 -64.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.714 -0.617 . . . . 0.0 111.649 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 679' ' ' LEU . 8.1 tp -68.22 -37.28 77.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 122.061 -0.399 . . . . 0.0 111.568 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.418 HG23 HD23 ' A' ' 669' ' ' LEU . 5.0 m -52.56 -33.69 46.91 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 122.095 -0.378 . . . . 0.0 111.727 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -65.88 -49.76 66.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.299 0.571 . . . . 0.0 110.686 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.4 t90 -65.26 -44.6 87.57 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.509 0.671 . . . . 0.0 109.352 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 675' ' ' ILE . 3.2 mm? -65.35 -35.61 81.48 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.964 -0.46 . . . . 0.0 111.729 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -93.28 -14.97 26.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -93.37 -12.95 28.73 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.608 -0.682 . . . . 0.0 111.787 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.1 pp -60.79 -36.57 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 O-C-N 121.872 -0.517 . . . . 0.0 110.442 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.474 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.3 ttt-85 -53.77 -47.43 70.74 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.613 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.498 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -73.84 -35.12 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.421 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.4 OUTLIER -58.75 -27.78 65.26 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.612 -177.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.964 HG21 HD12 ' B' ' 686' ' ' ILE . 14.9 mm -60.88 -42.09 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 121.513 0.673 . . . . 0.0 109.247 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 77.2 mt -71.04 -36.75 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.072 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 684' ' ' ILE . 30.8 mm -58.6 -37.31 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 O-C-N 122.043 -0.411 . . . . 0.0 109.996 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 685' ' ' PHE . 98.8 t -54.44 -42.01 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.76 -41.51 66.46 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -65.92 -38.71 89.39 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.834 0.826 . . . . 0.0 109.714 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -45.86 91.16 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.947 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.808 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -67.76 -42.0 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.785 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.42 -24.57 61.74 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.563 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -60.47 -39.22 86.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.014 0.911 . . . . 0.0 109.459 178.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 17.6 mmt180 -56.22 -28.44 58.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.889 0.875 . . . . 0.0 112.812 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.1 -37.21 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 O-C-N 121.17 -0.956 . . . . 0.0 108.67 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.733 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.8 p -67.69 -30.65 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 O-C-N 121.533 -0.729 . . . . 0.0 110.239 176.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.89 -28.99 59.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.071 0.463 . . . . 0.0 110.405 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.47 -37.0 72.2 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.0 m -63.58 -35.99 74.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 119.938 -0.705 . . . . 0.0 109.552 178.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.8 tp -61.01 -42.3 98.2 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.013 -0.429 . . . . 0.0 110.753 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 60.9 p -62.94 -35.02 78.72 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.371 0.605 . . . . 0.0 110.072 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.44 96.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 122.113 0.958 . . . . 0.0 108.852 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 701' ' ' VAL . 98.6 t -65.39 -45.11 94.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.029 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -62.91 -36.82 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.914 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.425 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 8.3 ttm180 -60.59 -47.5 85.94 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.43 0.633 . . . . 0.0 110.612 -178.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 748' ' ' LEU . 1.2 t -75.02 -44.37 44.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 122.188 0.995 . . . . 0.0 108.58 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -66.11 -18.71 65.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.973 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -97.22 -18.82 19.0 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.384 -0.823 . . . . 0.0 112.841 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 116.66 11.27 9.53 Favored Glycine 0 CA--C 1.54 1.601 0 O-C-N 121.385 -0.822 . . . . 0.0 112.751 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.455 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 63.32 -121.08 0.56 Allowed 'General case' 0 CA--C 1.565 1.521 0 O-C-N 121.935 -0.744 . . . . 0.0 111.053 179.322 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.455 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 69.7 p -62.77 159.35 45.22 Favored Pre-proline 0 C--N 1.351 0.672 0 O-C-N 120.84 -1.163 . . . . 0.0 111.519 -178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.485 ' HD2' HG21 ' C' ' 708' ' ' VAL . 83.0 Cg_exo -43.67 113.72 0.43 Allowed 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 121.758 1.639 . . . . 0.0 111.758 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.12 -20.27 13.06 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.483 1.225 0 CA-C-O 122.669 1.223 . . . . 0.0 110.876 -179.037 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 122.18 0.99 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 12.4 mtt-85 -58.03 -25.47 61.2 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.759 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -10.8 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.502 ' O ' HD12 ' A' ' 746' ' ' ILE . 7.1 mtm105 -70.71 -46.18 63.56 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.45 -0.782 . . . . 0.0 109.196 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -59.07 -46.1 89.14 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.191 0.52 . . . . 0.0 111.962 -178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.41 -28.61 63.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.57 0.7 . . . . 0.0 111.67 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 12.2 p -69.51 -36.46 76.47 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.011 -1.056 . . . . 0.0 111.726 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.9 mp -66.61 -46.79 85.2 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 CA-C-O 117.058 -1.449 . . . . 0.0 114.0 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -13.09 59.41 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 122.715 2.507 . . . . 0.0 109.453 -179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.631 HD13 ' HG3' ' B' ' 714' ' ' PRO . 56.5 tp -60.1 -17.23 38.4 Favored 'General case' 0 C--N 1.363 1.187 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 172.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.3 p -57.63 -44.82 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -70.9 -13.19 61.93 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 122.116 0.96 . . . . 0.0 109.447 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.11 -18.95 21.66 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 124.167 0.889 . . . . 0.0 111.329 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 70.6 p -57.38 -37.3 72.45 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 117.645 0.722 . . . . 0.0 109.06 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.93 -51.05 69.67 Favored 'General case' 0 C--N 1.346 0.414 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.86 -35.25 72.66 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.892 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.3 -44.99 92.49 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -61.71 -36.21 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.02 -30.56 70.68 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.625 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.533 ' OD1' HD22 ' B' ' 715' ' ' LEU . 13.2 m-20 -56.09 -50.15 71.83 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.407 -0.808 . . . . 0.0 109.154 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -71.49 -45.15 63.27 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.686 0.755 . . . . 0.0 111.624 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.457 ' O ' HD23 ' A' ' 760' ' ' LEU . 1.4 tt -61.53 -38.99 89.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.652 0.739 . . . . 0.0 112.359 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 13.5 ttm105 -82.59 -17.98 42.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 15.9 p -76.23 -46.16 29.48 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.481 -0.762 . . . . 0.0 112.706 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -68.6 -54.37 16.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.19 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 5.1 t -97.86 -49.51 4.78 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.039 0.923 . . . . 0.0 111.556 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 765' ' ' LEU . 7.9 tt 75.77 -71.3 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.298 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -108.4 -66.31 1.05 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.724 -0.61 . . . . 0.0 111.238 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 2.0 t -104.92 134.3 48.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.076 0.465 . . . . 0.0 110.476 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.451 ' CZ ' HD13 ' A' ' 771' ' ' LEU . 2.8 t80 -55.27 -21.63 15.25 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.981 0.419 . . . . 0.0 110.821 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -60.5 -39.92 89.46 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-O 121.726 0.774 . . . . 0.0 109.24 178.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -55.69 -29.5 59.52 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.837 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.501 HD11 HD22 ' A' ' 763' ' ' LEU . 9.2 tt -59.44 -34.77 72.92 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 122.157 -0.339 . . . . 0.0 110.606 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -56.88 -32.92 66.35 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -66.13 -46.84 76.13 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.572 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.5 tp -58.91 -38.65 79.4 Favored 'General case' 0 C--N 1.354 0.782 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.441 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 775' ' ' LEU . . . . . 0.446 ' O ' HD23 ' A' ' 775' ' ' LEU . 7.5 tt -63.38 -42.6 98.83 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.692 -0.63 . . . . 0.0 111.791 -178.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 43.9 mt -74.57 -39.64 62.13 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.71 -37.44 77.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.427 -178.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 18.4 m -60.4 -42.86 92.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.571 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.028 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.808 ' O ' HG22 ' A' ' 782' ' ' VAL . 24.2 p -63.79 -44.67 92.68 Favored 'General case' 0 C--N 1.343 0.303 0 O-C-N 122.042 -0.412 . . . . 0.0 111.768 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -33.69 76.13 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.44 ' HB ' HG21 ' B' ' 746' ' ' ILE . 60.6 mt -54.97 -37.1 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 O-C-N 121.911 -0.493 . . . . 0.0 110.663 -179.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 779' ' ' THR . 14.6 m -54.76 -38.15 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 O-C-N 121.209 -0.932 . . . . 0.0 109.69 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.16 -45.36 92.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.555 0.693 . . . . 0.0 110.753 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.89 -43.88 86.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.236 0.541 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.417 HD21 ' HG2' ' B' ' 747' ' ' ARG . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.531 0 CA-C-O 120.921 0.391 . . . . 0.0 111.509 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.461 ' O ' HD22 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 120.457 0.17 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.461 HD22 ' O ' ' B' ' 660' ' ' LEU . 0.0 OUTLIER 176.53 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -176.01 -179.35 1.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.634 0.731 . . . . 0.0 110.924 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.51 HD12 ' HG ' ' C' ' 660' ' ' LEU . 0.5 OUTLIER -56.58 -39.05 72.84 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.498 0.666 . . . . 0.0 109.837 179.474 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.12 -34.22 77.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.344 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -75.22 -47.12 29.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.087 0.47 . . . . 0.0 110.379 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.424 ' HE1' HD12 ' B' ' 661' ' ' LEU . 82.6 m95 -68.24 -46.0 71.69 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.501 0.667 . . . . 0.0 111.439 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.64 -19.21 65.82 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.045 -178.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.8 66.24 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.063 -0.398 . . . . 0.0 111.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.443 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -60.78 -36.32 78.68 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -59.9 -17.26 35.83 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.846 -0.534 . . . . 0.0 111.239 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -27.17 24.79 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.16 0.505 . . . . 0.0 110.205 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -64.04 -46.62 83.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.545 0.688 . . . . 0.0 110.431 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 21.0 t80 57.65 31.84 20.97 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.517 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -142.93 -70.41 0.33 Allowed 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.719 -0.613 . . . . 0.0 110.907 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.95 -37.5 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.05 -0.406 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.5 -33.87 46.92 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -65.67 -50.32 65.37 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.712 -0.617 . . . . 0.0 110.701 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.686 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.8 t90 -65.76 -42.45 90.88 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 122.017 0.913 . . . . 0.0 109.76 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -39.17 93.8 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.14 -178.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -97.15 -28.2 14.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -77.11 -15.59 59.5 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.468 -0.77 . . . . 0.0 111.901 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.686 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.9 pt -60.78 -37.35 75.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.894 -0.504 . . . . 0.0 111.006 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -53.66 -47.35 70.45 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.912 0.387 . . . . 0.0 110.805 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.495 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -70.64 -35.17 59.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.97 -27.89 67.2 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.205 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.964 HD12 HG21 ' A' ' 686' ' ' ILE . 18.1 mm -60.62 -48.2 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 O-C-N 121.827 -0.546 . . . . 0.0 109.789 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -64.88 -41.1 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.99 -38.06 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.22 -44.3 98.94 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.18 -26.7 9.5 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 13.7 m -60.52 -46.11 91.37 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.541 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.82 -32.89 71.07 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.364 -0.835 . . . . 0.0 112.504 -177.558 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.541 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -58.99 -47.02 91.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.96 -27.21 66.66 Favored Glycine 0 CA--C 1.541 1.699 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.565 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -59.33 -37.25 77.34 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.04 0.924 . . . . 0.0 110.089 179.455 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.808 ' HE ' HD11 ' A' ' 693' ' ' ILE . 12.8 mmt180 -55.39 -27.85 50.3 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -179.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.74 -36.86 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 O-C-N 121.028 -1.045 . . . . 0.0 109.01 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.565 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.6 p -67.41 -30.69 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 O-C-N 121.722 -0.611 . . . . 0.0 110.327 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.0 m-85 -56.49 -31.26 63.89 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.871 -0.518 . . . . 0.0 110.153 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.61 78.7 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -37.73 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.665 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.5 tp -56.86 -37.92 71.99 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.761 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 51.0 m -62.83 -36.15 82.25 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.18 0.514 . . . . 0.0 110.837 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -44.85 90.34 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 122.238 1.018 . . . . 0.0 108.826 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.691 HG22 HD13 ' B' ' 748' ' ' LEU . 76.9 t -65.36 -45.14 94.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 122.522 1.153 . . . . 0.0 109.211 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -62.69 -35.87 81.08 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.557 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -65.74 -49.41 68.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.488 0.661 . . . . 0.0 112.323 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -44.17 31.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.25 -45.35 91.43 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -175.282 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.43 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 2.4 pt20 -104.67 -24.56 12.94 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.67 177.31 14.84 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -113.43 -62.68 1.56 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.736 -0.861 . . . . 0.0 112.804 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 8.4 p -62.76 159.3 45.5 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.388 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.631 ' HG3' HD13 ' A' ' 748' ' ' LEU . 86.5 Cg_exo -29.81 108.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 122.76 2.307 . . . . 0.0 112.961 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.533 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.9 tt -67.02 -16.72 64.54 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 121.763 0.792 . . . . 0.0 109.547 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.488 0.661 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -58.6 -26.86 64.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.167 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -55.72 -12.28 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -68.41 -40.97 81.08 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.563 -0.711 . . . . 0.0 111.567 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -58.5 -41.14 84.69 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.506 -0.746 . . . . 0.0 110.664 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.26 -36.96 71.95 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.244 0.545 . . . . 0.0 110.021 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 8.9 p -56.96 -46.22 82.31 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 122.056 -0.402 . . . . 0.0 110.44 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.44 HG21 ' HB ' ' A' ' 781' ' ' ILE . 1.8 mp -53.34 -19.22 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.081 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.417 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.0 OUTLIER -59.39 -28.13 66.61 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.126 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.691 HD13 HG22 ' B' ' 705' ' ' VAL . 4.2 pp -55.61 -21.29 16.94 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.941 0.401 . . . . 0.0 110.374 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 48.4 t -55.61 -53.95 31.11 Favored 'Isoleucine or valine' 0 C--N 1.35 0.596 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -72.61 -22.66 60.93 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.689 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.23 -20.68 36.85 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.999 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 18.4 m -59.5 -38.97 82.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 117.884 0.842 . . . . 0.0 109.631 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 16.9 tp -67.89 -51.18 51.0 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.436 0.636 . . . . 0.0 109.995 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.55 81.0 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.3 0.571 . . . . 0.0 111.513 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 5.7 tt -60.81 -45.49 94.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.903 0.382 . . . . 0.0 111.618 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 54.8 mt -65.64 -37.32 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 121.654 0.74 . . . . 0.0 109.229 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.13 -30.06 68.24 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.673 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.509 ' OD1' HD22 ' C' ' 715' ' ' LEU . 82.7 m-20 -55.35 -46.91 76.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.531 -0.731 . . . . 0.0 109.767 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.36 -45.23 66.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-O 121.063 0.458 . . . . 0.0 112.166 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 43.4 mt -69.2 -45.35 70.13 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.475 0.655 . . . . 0.0 112.748 -178.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -60.86 -43.19 98.7 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.8 m -59.69 -42.97 94.16 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.413 -0.805 . . . . 0.0 111.323 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -68.0 -54.23 20.01 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.584 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.81 -48.11 5.32 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.653 0.739 . . . . 0.0 112.051 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 78.21 -54.74 0.49 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.654 0.782 . . . . 0.0 111.343 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -137.51 119.46 15.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 111.236 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 16.7 m 54.02 177.3 0.02 OUTLIER 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.147 0.499 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 768' ' ' TYR . . . . . 0.461 ' CD1' HD13 ' B' ' 771' ' ' LEU . 4.9 m-85 -97.49 -2.11 42.67 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.958 -0.464 . . . . 0.0 111.621 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -74.3 -43.15 57.99 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -62.24 -29.96 70.76 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.262 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' B' ' 768' ' ' TYR . 0.2 OUTLIER -59.79 -31.08 69.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -56.94 -35.61 69.28 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.466 0.651 . . . . 0.0 109.425 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -69.02 -34.93 76.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.311 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.502 HD13 ' HG ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.45 -37.95 76.51 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.023 0.439 . . . . 0.0 110.576 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.34 -36.54 73.58 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 0.0 111.65 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.35 -48.09 71.37 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.775 -0.578 . . . . 0.0 111.623 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 17.4 pt -56.35 -34.94 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 O-C-N 122.004 -0.435 . . . . 0.0 110.4 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.432 ' HA ' HG12 ' B' ' 781' ' ' ILE . 56.2 t -53.44 -43.16 51.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -178.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.06 -36.49 84.18 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.75 0.786 . . . . 0.0 110.22 177.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -63.33 -36.43 83.65 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.155 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.968 HG23 HG23 ' C' ' 746' ' ' ILE . 3.7 mm -54.79 -55.45 15.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 O-C-N 122.11 -0.369 . . . . 0.0 110.933 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 31.3 m -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.39 0.614 . . . . 0.0 110.355 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.98 -42.05 99.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.196 0.522 . . . . 0.0 111.474 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 12.1 tp -68.66 -39.43 80.64 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.956 0.884 . . . . 0.0 110.226 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.677 HD12 ' O ' ' B' ' 781' ' ' ILE . 0.8 OUTLIER -76.99 -23.0 52.29 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.459 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.58 -54.62 8.74 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.32 125.4 37.9 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.402 0.62 . . . . 0.0 110.323 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.632 -179.474 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.641 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.385 0.612 . . . . 0.0 110.016 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.517 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.1 mp 56.84 102.71 0.02 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 121.587 0.708 . . . . 0.0 110.585 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -164.13 171.07 15.57 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.717 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.466 HD23 ' C ' ' C' ' 663' ' ' LEU . 10.5 tt -51.93 -61.93 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.588 0.708 . . . . 0.0 110.853 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.81 -16.61 63.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.279 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -81.22 -46.15 15.25 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 122.06 -0.4 . . . . 0.0 111.194 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -64.84 -45.98 83.82 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.667 0.746 . . . . 0.0 110.013 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.32 -21.21 66.25 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.431 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 48.4 t -69.63 -29.69 67.24 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.884 -0.51 . . . . 0.0 111.483 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' C' ' 669' ' ' LEU . 4.4 mm? -59.85 -37.66 79.91 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.129 0.49 . . . . 0.0 110.795 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -59.87 -18.94 48.29 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 111.297 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -81.21 -28.33 34.94 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.425 0.631 . . . . 0.0 110.777 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -60.05 -46.51 89.3 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.586 0.708 . . . . 0.0 110.209 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.23 36.62 27.62 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.428 0.632 . . . . 0.0 111.66 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.6 -73.36 0.14 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.734 -0.604 . . . . 0.0 111.772 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.688 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.1 -37.33 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.366 0.603 . . . . 0.0 111.608 -178.829 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.76 -33.72 36.23 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.918 -0.488 . . . . 0.0 111.983 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -60.63 -50.19 74.52 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.721 -0.612 . . . . 0.0 109.665 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.5 t90 -65.67 -40.08 92.02 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 121.761 0.791 . . . . 0.0 109.815 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.548 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -65.44 -35.78 81.93 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.251 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -104.91 -20.52 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -176.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -86.97 -12.94 46.04 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.48 -0.763 . . . . 0.0 112.159 -179.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.1 pp -60.75 -36.35 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 122.033 -0.417 . . . . 0.0 110.329 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.499 ' N ' HD12 ' C' ' 682' ' ' ILE . 8.4 ttt-85 -53.9 -47.1 71.48 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.934 0.397 . . . . 0.0 110.467 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.445 HG22 HD12 ' C' ' 688' ' ' ILE . 1.7 mp -66.34 -36.35 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.676 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.8 -33.73 72.12 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.955 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.77 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.95 -52.01 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.074 0.464 . . . . 0.0 110.083 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 61.3 mt -62.84 -37.07 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 121.709 0.766 . . . . 0.0 108.934 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.445 HD12 HG22 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -58.82 -37.57 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.676 HG23 ' O ' ' C' ' 685' ' ' PHE . 61.7 t -55.16 -40.03 53.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 690' ' ' GLY . . . . . 0.417 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.65 -39.49 75.86 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -67.66 -38.77 84.23 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.976 0.893 . . . . 0.0 109.384 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -46.33 90.2 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.224 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.533 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.3 pp -65.27 -41.91 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 121.353 0.596 . . . . 0.0 109.848 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.556 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.76 -25.9 64.3 Favored Glycine 0 CA--C 1.539 1.588 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.42 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.4 tt -58.38 -37.8 75.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.723 0.773 . . . . 0.0 110.271 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -55.44 -28.71 56.02 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.556 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.79 -36.44 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 120.874 -1.141 . . . . 0.0 111.804 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.42 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -59.1 -30.39 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.271 -0.893 . . . . 0.0 110.19 178.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -56.41 -30.71 63.11 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.839 -0.538 . . . . 0.0 110.18 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.81 -37.78 77.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -44.33 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.97 -36.95 75.7 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.72 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 66.6 m -62.05 -37.26 84.29 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -40.91 95.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 122.0 0.905 . . . . 0.0 108.779 178.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.528 HG13 HD13 ' C' ' 748' ' ' LEU . 96.7 t -65.69 -44.98 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.693 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -62.79 -36.29 82.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.49 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.58 -48.69 78.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.8 0.81 . . . . 0.0 110.296 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.485 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -76.0 -43.96 38.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.978 -178.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 709' ' ' ARG . . . . . 0.414 ' HB2' HD22 ' C' ' 748' ' ' LEU . 4.5 tmm_? -73.07 -36.23 66.82 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.482 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -102.48 -7.66 21.72 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 99.83 166.29 29.34 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -110.83 -63.0 1.45 Allowed 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.715 -0.874 . . . . 0.0 111.681 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 76.3 p -90.57 159.62 40.73 Favored Pre-proline 0 C--O 1.234 0.273 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.209 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_exo -38.93 119.32 0.43 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.561 1.508 . . . . 0.0 111.801 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.509 HD22 ' OD1' ' B' ' 758' ' ' ASP . 3.0 tt -96.47 4.52 52.05 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -175.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.928 0.87 . . . . 0.0 112.047 -179.449 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 . . . . . 0 C--O 1.234 0.274 0 CA-C-O 122.172 0.987 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -65.67 -26.71 67.91 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.584 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -55.98 -15.21 3.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.495 ' O ' HD12 ' C' ' 746' ' ' ILE . 45.6 mtm-85 -56.06 -33.45 65.02 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.82 -0.55 . . . . 0.0 110.8 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -58.28 -40.25 81.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.618 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -47.83 54.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.058 0.456 . . . . 0.0 110.455 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 745' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' C' ' 742' ' ' ARG . 2.3 p -57.01 -34.88 68.6 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.968 HG23 HG23 ' B' ' 781' ' ' ILE . 0.3 OUTLIER -52.85 -23.23 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 O-C-N 121.658 -0.651 . . . . 0.0 109.856 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -60.18 -24.35 64.69 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.553 0.692 . . . . 0.0 110.069 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.528 HD13 HG13 ' C' ' 705' ' ' VAL . 3.0 pp -61.37 -26.34 67.77 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.904 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 82.3 t -55.81 -53.91 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.614 ' CG ' HD22 ' B' ' 785' ' ' LEU . 9.5 m120 -72.69 -22.84 60.84 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.588 175.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -22.88 46.66 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.906 -177.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 38.1 t -61.2 -41.2 96.41 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.832 -0.805 . . . . 0.0 109.543 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.9 tp -68.12 -46.23 71.48 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 109.938 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.98 -35.56 81.1 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.689 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.483 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.2 tt -60.0 -45.43 92.76 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.268 0.556 . . . . 0.0 110.72 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 45.5 mm -67.43 -40.95 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.138 0.97 . . . . 0.0 108.723 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.44 -30.34 71.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.529 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -55.24 -44.0 75.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.552 -0.717 . . . . 0.0 110.892 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.13 -45.12 67.5 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.309 0.576 . . . . 0.0 110.891 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 26.9 mt -67.26 -40.22 86.2 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -67.29 -50.63 59.55 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 1.3 m -68.35 -43.3 77.74 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.228 1.013 . . . . 0.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.55 -52.68 56.41 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.96 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.79 -34.02 11.04 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.127 -0.983 . . . . 0.0 113.418 -177.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.03 177.25 0.24 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -38.14 -66.3 0.27 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 30.9 m -97.17 162.01 13.55 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.853 -0.529 . . . . 0.0 110.649 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.29 -29.7 62.9 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.839 0.352 . . . . 0.0 110.676 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -53.83 -32.04 51.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.815 0.817 . . . . 0.0 109.471 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 -69.91 -30.54 67.97 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.04 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.4 -43.39 96.73 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -56.78 -36.97 70.47 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.494 0.664 . . . . 0.0 109.428 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -69.17 -39.42 78.75 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.23 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.411 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -65.12 -38.11 89.61 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 121.087 0.47 . . . . 0.0 110.855 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.429 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.7 mp -58.4 -37.79 76.02 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.269 0.557 . . . . 0.0 110.256 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 57.4 mt -74.81 -36.72 62.45 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.486 0.66 . . . . 0.0 110.06 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.445 HG22 ' CD1' ' C' ' 781' ' ' ILE . 40.2 mt -61.26 -47.88 91.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.719 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.446 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -56.06 -39.33 57.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 O-C-N 121.641 -0.662 . . . . 0.0 111.182 -178.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.685 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.2 m -61.01 -47.95 84.08 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.402 -0.811 . . . . 0.0 110.978 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -68.23 -36.53 79.64 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.809 -0.557 . . . . 0.0 111.535 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.445 ' CD1' HG22 ' C' ' 777' ' ' ILE . 72.9 mt -54.93 -38.23 44.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 CA-C-O 118.644 -0.693 . . . . 0.0 111.954 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.685 HG22 ' O ' ' C' ' 779' ' ' THR . 14.2 m -53.2 -36.79 26.26 Favored 'Isoleucine or valine' 0 C--N 1.354 0.787 0 CA-C-N 120.169 1.35 . . . . 0.0 109.092 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 . . . . . 0 CA--C 1.553 1.088 0 O-C-N 121.344 -0.848 . . . . 0.0 110.688 178.282 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.525 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 37.4 mt 61.46 113.23 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.598 0.713 . . . . 0.0 110.306 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -177.55 179.11 0.96 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.75 -41.81 67.51 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.365 0.603 . . . . 0.0 110.367 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -73.71 -32.87 64.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -78.01 -44.36 26.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.135 0.493 . . . . 0.0 111.199 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -65.04 -45.3 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.189 0.518 . . . . 0.0 110.475 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.35 -20.91 65.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.223 0.535 . . . . 0.0 111.362 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 668' ' ' SER . . . . . 0.401 ' O ' ' ND2' ' A' ' 671' ' ' ASN . 3.8 t -65.17 -39.4 92.88 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.0 mm? -59.89 -27.69 66.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.039 0.447 . . . . 0.0 111.873 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.0 m95 -60.18 -24.6 64.9 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.822 -0.549 . . . . 0.0 112.132 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 671' ' ' ASN . . . . . 0.401 ' ND2' ' O ' ' A' ' 668' ' ' SER . 0.8 OUTLIER -86.61 -15.59 39.3 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.651 -0.655 . . . . 0.0 111.861 179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -65.66 -45.98 80.89 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.497 0.665 . . . . 0.0 110.378 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 45.9 t80 58.42 42.49 21.16 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -161.02 -69.28 0.06 Allowed 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.653 -0.654 . . . . 0.0 111.733 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.33 -36.7 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 122.095 -0.378 . . . . 0.0 111.923 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 6.9 m -52.04 -34.5 43.6 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -65.83 -50.07 65.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.381 0.61 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -65.72 -44.13 86.99 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.698 0.761 . . . . 0.0 110.345 178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -36.0 82.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -95.51 -42.82 8.26 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -70.69 -3.71 19.9 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.557 -0.715 . . . . 0.0 112.755 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.732 HD12 ' H ' ' A' ' 683' ' ' ARG . 1.1 pp -60.91 -36.66 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.672 -0.642 . . . . 0.0 110.038 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.732 ' H ' HD12 ' A' ' 682' ' ' ILE . 9.7 ttt-85 -56.99 -47.13 81.53 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.177 0.513 . . . . 0.0 110.478 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.462 ' O ' HD13 ' A' ' 688' ' ' ILE . 1.8 mp -70.59 -33.2 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -28.48 69.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.584 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 17.0 mm -60.95 -48.07 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.292 0.568 . . . . 0.0 109.656 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 80.1 mt -60.36 -36.94 72.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.462 HD13 ' O ' ' A' ' 684' ' ' ILE . 1.4 mp -60.09 -38.35 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -55.21 -40.86 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.88 -33.27 77.74 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -66.73 -38.71 87.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.95 0.881 . . . . 0.0 110.998 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -46.03 90.69 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -61.43 -41.65 90.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 O-C-N 121.716 -0.615 . . . . 0.0 109.764 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.22 -39.76 97.62 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 178.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.478 ' O ' HG12 ' A' ' 698' ' ' VAL . 4.3 tt -62.43 -40.37 96.35 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.869 0.842 . . . . 0.0 109.7 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.711 ' HE ' HD11 ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.95 -28.08 55.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.66 0.784 . . . . 0.0 112.188 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.9 -34.8 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.551 -0.718 . . . . 0.0 109.41 -177.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.761 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.1 p -53.81 -29.1 17.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 O-C-N 121.534 -0.729 . . . . 0.0 110.307 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -54.77 -28.68 50.53 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.808 -0.558 . . . . 0.0 110.504 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -36.57 70.19 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.3 m -61.29 -35.83 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 CA-C-O 121.674 0.75 . . . . 0.0 109.474 177.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.74 -41.95 96.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.11 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 56.3 p -62.48 -31.92 72.74 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.641 0.734 . . . . 0.0 109.679 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.512 HD22 HH12 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.48 -47.14 87.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.662 1.22 . . . . 0.0 108.667 177.917 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.415 ' CG2' HD12 ' A' ' 748' ' ' LEU . 80.7 t -64.63 -45.15 96.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.363 -1.289 . . . . 0.0 109.29 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 706' ' ' ASN . . . . . 0.53 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 7.8 m120 -62.31 -36.98 83.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.512 HH12 HD22 ' A' ' 704' ' ' LEU . 38.3 ttm105 -57.57 -48.46 79.29 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.725 -1.235 . . . . 0.0 110.083 -179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.5 t -76.42 -44.45 35.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.404 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.98 -16.03 61.08 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 710' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 1.8 tt0 -101.26 -8.45 22.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.031 -1.043 . . . . 0.0 113.468 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.38 18.1 10.68 Favored Glycine 0 CA--C 1.541 1.664 0 O-C-N 121.824 -0.548 . . . . 0.0 112.55 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.417 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.3 OUTLIER 54.13 -125.03 2.27 Favored 'General case' 0 CA--C 1.566 1.567 0 O-C-N 121.831 -0.805 . . . . 0.0 110.243 179.281 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.417 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 0.3 OUTLIER -62.13 159.71 36.4 Favored Pre-proline 0 C--N 1.353 0.734 0 O-C-N 120.754 -1.216 . . . . 0.0 109.689 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -45.4 104.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 121.177 1.251 . . . . 0.0 111.56 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.24 -20.33 16.65 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -177.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.549 0.909 0 CA-C-O 122.24 1.019 . . . . 0.0 111.052 -179.769 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.708 0.766 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -57.84 -25.28 60.47 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.001 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -12.33 0.68 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -177.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -42.26 89.18 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.479 -0.763 . . . . 0.0 109.021 177.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' C' ' 781' ' ' ILE . 19.5 m-20 -64.91 -36.1 83.27 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -36.67 77.05 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.69 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.5 p -63.76 -45.3 90.46 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.66 HD12 ' CD1' ' C' ' 781' ' ' ILE . 40.7 mt -55.32 -21.11 8.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.973 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.544 ' NH1' HG22 ' C' ' 781' ' ' ILE . 1.9 mmp_? -59.86 -30.48 69.0 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.629 -0.669 . . . . 0.0 109.201 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.837 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -62.07 -16.69 53.96 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.167 0.508 . . . . 0.0 110.315 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.57 -55.12 16.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.885 0 O-C-N 120.96 -1.088 . . . . 0.0 108.123 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -72.96 -22.0 60.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 122.507 1.146 . . . . 0.0 108.953 174.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.45 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.72 -19.65 29.1 Favored Glycine 0 C--O 1.219 -0.843 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.211 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 88.3 p -57.98 -37.65 74.62 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.046 0.923 . . . . 0.0 109.065 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.2 tp -66.64 -51.1 60.02 Favored 'General case' 0 C--N 1.343 0.294 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.41 73.38 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.087 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.0 tt -58.67 -45.07 90.21 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.931 -0.481 . . . . 0.0 111.696 -176.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.73 -34.2 61.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.7 -29.48 66.9 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.941 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 20.2 m-20 -54.6 -49.02 71.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.324 -0.86 . . . . 0.0 109.686 -177.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.68 -44.93 65.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.527 0.679 . . . . 0.0 111.327 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 3.6 mt -65.74 -29.79 70.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 70.7 mtt180 -73.59 -27.79 61.48 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -45.74 39.43 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.368 -0.832 . . . . 0.0 110.446 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.706 ' HA ' HD22 ' A' ' 774' ' ' LEU . 6.3 mp -68.96 -54.94 12.62 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 -49.19 4.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.612 0.72 . . . . 0.0 111.785 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.422 ' C ' HD23 ' A' ' 765' ' ' LEU . 4.5 tt 79.21 -66.9 0.17 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.432 0.693 . . . . 0.0 110.988 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -112.64 -61.33 1.74 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.751 -0.593 . . . . 0.0 111.794 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 1.3 m -120.23 157.64 28.68 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.264 0.554 . . . . 0.0 110.732 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -21.16 66.06 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.769 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 65.0 m-70 -56.85 -42.0 78.94 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.307 1.051 . . . . 0.0 108.327 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -28.62 69.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.424 177.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.699 HD11 HD23 ' A' ' 763' ' ' LEU . 0.1 OUTLIER -58.5 -37.47 75.65 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.571 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.99 -32.89 72.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.21 -47.52 73.59 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 122.206 -0.309 . . . . 0.0 111.053 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 763' ' ' LEU . 6.1 tp -61.13 -37.8 84.12 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.977 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 25.6 mt -58.59 -36.41 73.96 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.83 -0.544 . . . . 0.0 112.045 -177.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 32.5 mt -74.55 -48.54 26.28 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.495 -0.753 . . . . 0.0 111.632 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.69 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.9 pp -70.69 -37.36 68.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 O-C-N 122.178 -0.326 . . . . 0.0 111.619 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.69 ' N ' HD12 ' A' ' 777' ' ' ILE . 9.8 p -58.71 -44.34 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 21.0 p -64.06 -35.56 81.15 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-O 122.223 1.011 . . . . 0.0 109.504 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -60.79 -45.42 94.45 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.481 HD12 ' HB ' ' B' ' 746' ' ' ILE . 2.7 pt -64.53 -41.94 93.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.108 -177.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.67 -38.6 82.69 Favored 'Isoleucine or valine' 0 C--N 1.346 0.451 0 CA-C-N 119.066 0.848 . . . . 0.0 111.025 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.41 -45.6 83.32 Favored 'General case' 0 C--N 1.35 0.588 0 O-C-N 121.715 -0.616 . . . . 0.0 111.031 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.42 ' O ' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -70.49 -40.21 73.72 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.382 -179.292 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.405 HD11 HH11 ' B' ' 747' ' ' ARG . 3.6 tp . . . . . 0 C--O 1.214 -0.792 0 O-C-N 122.06 -0.4 . . . . 0.0 110.861 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 54.74 96.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.554 0.692 . . . . 0.0 110.483 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -173.39 164.99 4.71 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.14 -37.64 67.22 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.471 0.653 . . . . 0.0 109.9 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -65.28 -36.92 85.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.699 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 10.9 tttm -80.63 -49.22 11.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.218 0.532 . . . . 0.0 110.125 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -56.53 -44.28 80.66 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.462 0.649 . . . . 0.0 110.029 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.66 -28.95 69.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.362 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 23.0 t -62.07 -36.82 82.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 111.242 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.467 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.8 mm? -59.78 -23.73 63.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 122.055 -0.403 . . . . 0.0 111.719 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -59.55 -29.0 67.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.32 0.581 . . . . 0.0 110.288 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.05 -7.71 56.62 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.212 0.53 . . . . 0.0 110.846 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 672' ' ' TRP . . . . . 0.44 ' O ' ' N ' ' B' ' 674' ' ' ASP . 14.4 m95 -94.54 34.64 1.29 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.333 0.587 . . . . 0.0 109.802 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -39.81 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 122.087 0.946 . . . . 0.0 113.35 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 674' ' ' ASP . . . . . 0.44 ' N ' ' O ' ' B' ' 672' ' ' TRP . 1.6 t70 177.7 -66.07 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.672 0.748 . . . . 0.0 110.134 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.69 -36.93 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.099 0.56 . . . . 0.0 112.022 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.4 m -51.6 -33.74 34.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -64.38 -50.02 69.33 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 121.744 -0.597 . . . . 0.0 109.884 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.633 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.64 -43.05 90.64 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.748 0.785 . . . . 0.0 109.52 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.72 80.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 15.4 t90 -100.48 -45.9 5.4 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -63.55 -7.21 6.47 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.594 -0.691 . . . . 0.0 112.398 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.8 pp -60.44 -36.43 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 O-C-N 121.652 -0.655 . . . . 0.0 110.418 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' B' ' 682' ' ' ILE . 8.2 ttt-85 -53.7 -47.35 70.59 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.048 -0.408 . . . . 0.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.482 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.1 mp -69.01 -36.05 71.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -31.41 69.75 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.607 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.763 HD12 HG21 ' A' ' 686' ' ' ILE . 14.1 mm -60.68 -46.56 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.74 -41.45 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.29 -37.74 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 53.5 t -59.11 -40.12 80.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.89 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.23 -27.22 67.16 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.752 -0.592 . . . . 0.0 111.822 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.0 m -60.66 -41.43 95.0 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -177.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.646 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.3 -33.2 70.8 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 121.486 -0.759 . . . . 0.0 112.372 -176.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.776 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -66.27 -40.38 86.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 121.453 -0.779 . . . . 0.0 109.896 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.504 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.89 -33.94 85.4 Favored Glycine 0 CA--C 1.543 1.807 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.415 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.9 tt -69.81 -37.22 76.18 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.866 0.841 . . . . 0.0 110.323 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.46 ' HE ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -55.08 -27.5 45.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.447 1.099 . . . . 0.0 113.832 -178.574 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.504 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.8 tt -57.71 -34.86 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.26 -0.9 . . . . 0.0 109.704 -177.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.415 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.2 p -53.52 -28.93 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 O-C-N 121.603 -0.686 . . . . 0.0 110.002 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -55.39 -30.7 60.89 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.612 -0.68 . . . . 0.0 109.993 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.77 78.0 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.5 -41.13 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.78 -37.78 80.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.303 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 44.1 p -62.47 -41.69 98.95 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.57 -178.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.85 -40.58 89.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.677 0.751 . . . . 0.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.34 -43.61 87.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -62.72 -36.58 83.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.348 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -65.65 -49.39 68.82 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.703 1.239 . . . . 0.0 109.49 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD11 ' B' ' 748' ' ' LEU . 9.4 t -77.4 -45.37 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -176.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -63.91 -44.81 91.83 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -174.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 7.9 pt20 -104.59 -24.14 13.03 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.95 165.11 10.13 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 712' ' ' TYR . . . . . 0.487 ' O ' HD11 ' A' ' 704' ' ' LEU . 24.5 p90 -106.7 -57.28 2.08 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.195 -0.591 . . . . 0.0 112.166 -179.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 65.7 p -74.83 159.16 83.68 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.313 -0.851 . . . . 0.0 108.792 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -32.89 124.5 0.11 Allowed 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.238 1.959 . . . . 0.0 112.376 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.431 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.6 tt -79.09 -14.93 58.84 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 121.945 0.878 . . . . 0.0 112.538 -178.798 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.628 0 CA-C-O 121.39 0.614 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -71.34 -26.5 62.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.105 0.479 . . . . 0.0 111.259 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.5 -10.58 0.67 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -56.13 -30.73 62.54 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.365 -0.834 . . . . 0.0 110.311 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.49 -41.66 97.6 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -37.17 72.21 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.567 178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 745' ' ' SER . . . . . 0.495 ' O ' HD12 ' B' ' 748' ' ' LEU . 63.2 p -56.93 -36.0 69.73 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.481 ' HB ' HD12 ' A' ' 781' ' ' ILE . 1.2 mp -55.34 -18.3 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.405 HH11 HD11 ' A' ' 785' ' ' LEU . 14.9 ttm180 -59.48 -28.13 66.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.664 HD11 HG11 ' B' ' 708' ' ' VAL . 0.3 OUTLIER -55.54 -21.75 18.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.094 0.474 . . . . 0.0 109.856 177.838 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 749' ' ' VAL . . . . . 0.419 HG23 ' O ' ' B' ' 746' ' ' ILE . 54.1 t -55.84 -54.19 29.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -72.94 -24.48 60.81 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.436 174.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.08 33.57 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.77 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.68 -37.94 77.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.001 0.901 . . . . 0.0 108.948 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.78 -49.4 58.95 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.4 0.619 . . . . 0.0 109.762 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.41 80.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.248 0.547 . . . . 0.0 112.359 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.4 tt -60.24 -45.53 92.93 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.425 0.631 . . . . 0.0 110.882 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.73 -39.29 85.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 122.004 0.907 . . . . 0.0 108.653 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.44 68.62 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.082 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 85.7 m-20 -55.15 -49.07 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.456 -0.777 . . . . 0.0 110.963 -177.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -70.3 -40.86 73.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.109 0.481 . . . . 0.0 110.809 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.1 mt -69.15 -31.06 69.47 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.6 -49.75 56.91 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.828 -0.545 . . . . 0.0 112.271 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 4.0 m -69.18 -41.07 77.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.743 0.782 . . . . 0.0 110.921 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.545 ' HA ' HD22 ' B' ' 774' ' ' LEU . 2.2 tp -59.99 -53.31 59.31 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.471 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 764' ' ' SER . . . . . 0.425 ' HB2' HD12 ' B' ' 771' ' ' LEU . 23.1 t -97.35 -10.74 25.02 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.526 -0.734 . . . . 0.0 112.966 -178.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 mt 68.7 -73.47 0.09 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -138.76 -77.23 0.36 Allowed 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.864 -0.523 . . . . 0.0 110.08 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m -79.73 148.78 31.38 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.853 -0.529 . . . . 0.0 110.125 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -37.38 82.89 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.099 0.476 . . . . 0.0 110.122 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -54.46 -39.62 67.64 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.682 0.753 . . . . 0.0 109.494 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -59.49 -30.07 68.3 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.038 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 771' ' ' LEU . 3.8 tt -60.11 -38.41 82.91 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -40.52 85.19 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.23 -43.86 93.62 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.4 OUTLIER -59.51 -36.91 77.0 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 121.694 0.759 . . . . 0.0 110.539 178.567 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.85 -35.98 69.5 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.481 -0.762 . . . . 0.0 109.846 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 776' ' ' LEU . . . . . 0.45 ' O ' HG22 ' B' ' 779' ' ' THR . 70.8 mt -64.58 -37.65 88.28 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.85 -0.531 . . . . 0.0 110.797 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 9.9 pt -69.64 -35.49 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 O-C-N 121.63 -0.669 . . . . 0.0 109.393 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.407 ' HA ' HG12 ' B' ' 781' ' ' ILE . 72.6 t -54.04 -46.21 65.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 776' ' ' LEU . 4.8 t -64.02 -34.84 78.91 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.224 -0.922 . . . . 0.0 109.824 176.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -31.23 70.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 121.278 0.561 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.752 HD12 HG13 ' C' ' 746' ' ' ILE . 39.3 mm -54.35 -55.37 15.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.571 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.39 -38.75 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-O 121.655 0.741 . . . . 0.0 110.875 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.88 -41.87 95.27 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.745 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.37 -43.9 69.18 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.324 0.583 . . . . 0.0 111.285 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.694 HD23 ' OD1' ' C' ' 750' ' ' ASN . 5.4 tp -87.37 -9.37 55.0 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.63 -38.62 82.68 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.96 109.92 19.1 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 122.286 -0.538 . . . . 0.0 110.084 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.22 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.506 ' N ' HD23 ' C' ' 660' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.937 0 CA-C-O 120.419 0.152 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.409 HD22 ' CZ2' ' C' ' 666' ' ' TRP . 36.4 mt 56.04 99.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.48 0.657 . . . . 0.0 110.546 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.77 168.04 12.69 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.325 0.583 . . . . 0.0 110.236 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.525 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.3 tm? -43.58 -51.74 6.7 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.451 0.643 . . . . 0.0 112.232 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.481 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -71.9 -28.0 63.21 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -81.32 -32.27 33.15 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 122.05 -0.406 . . . . 0.0 111.496 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.409 ' CZ2' HD22 ' C' ' 661' ' ' LEU . 76.0 m95 -68.75 -46.35 69.05 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.236 0.541 . . . . 0.0 110.38 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.04 84.64 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.992 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -26.04 67.78 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.398 0.618 . . . . 0.0 110.63 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -34.37 74.21 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.16 0.505 . . . . 0.0 110.898 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -75.59 -14.57 60.39 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 122.13 -0.356 . . . . 0.0 111.749 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -67.64 -33.78 75.65 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.587 0.708 . . . . 0.0 110.334 179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m0 -55.99 -40.09 72.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.595 0.712 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.54 43.25 23.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.78 0.8 . . . . 0.0 111.398 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -159.69 -65.52 0.07 Allowed 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.62 -0.675 . . . . 0.0 112.016 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.74 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -67.6 -38.24 80.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 121.444 0.64 . . . . 0.0 111.432 -178.593 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.2 m -52.94 -33.79 52.46 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -62.11 -50.05 73.46 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.817 -0.552 . . . . 0.0 111.69 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.656 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -65.41 -44.23 88.07 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.431 0.634 . . . . 0.0 109.389 178.911 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.523 ' O ' HD23 ' C' ' 679' ' ' LEU . 1.1 tt -64.28 -35.78 81.95 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.069 -178.139 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -95.93 -20.51 18.7 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.72 -19.18 29.54 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.714 -0.616 . . . . 0.0 111.648 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.656 HG23 ' O ' ' C' ' 678' ' ' TRP . 7.6 pt -60.66 -36.8 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 O-C-N 121.836 -0.54 . . . . 0.0 110.321 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -55.02 -47.15 75.11 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.172 0.51 . . . . 0.0 110.036 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.401 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -67.8 -33.87 64.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.52 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -60.17 -29.78 68.9 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.859 179.643 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 8.0 mm -64.42 -47.4 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.305 0.574 . . . . 0.0 109.708 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.3 mt -64.74 -39.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.92 -37.71 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.458 HG23 ' O ' ' C' ' 685' ' ' PHE . 56.0 t -54.8 -40.91 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.61 -41.32 64.79 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.0 m -66.73 -38.5 86.81 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.864 0.84 . . . . 0.0 109.497 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.35 -43.7 92.77 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.171 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.711 HD11 ' HE ' ' A' ' 696' ' ' ARG . 0.1 OUTLIER -68.5 -42.23 83.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.956 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.476 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.58 -34.14 84.75 Favored Glycine 0 CA--C 1.535 1.338 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.82 -36.93 63.04 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.322 1.058 . . . . 0.0 110.173 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.776 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.9 mmt180 -55.62 -28.59 56.1 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.476 HG22 ' O ' ' C' ' 694' ' ' GLY . 6.8 tp -59.27 -36.59 64.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 O-C-N 121.076 -1.015 . . . . 0.0 112.083 -175.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -56.51 -30.74 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.294 -0.879 . . . . 0.0 110.439 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -58.59 -31.75 68.33 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.8 -45.45 92.29 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.484 ' O ' HG23 ' C' ' 705' ' ' VAL . 1.8 t -65.93 -39.31 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.643 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.75 -37.68 87.53 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.78 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -68.37 -37.81 80.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.219 0.533 . . . . 0.0 110.596 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.39 -40.83 93.95 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.873 0.844 . . . . 0.0 108.955 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.484 HG23 ' O ' ' C' ' 701' ' ' VAL . 71.6 t -67.63 -45.57 84.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.981 0.896 . . . . 0.0 108.947 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 706' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 2.3 m120 -63.15 -36.49 83.78 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.418 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -49.57 74.16 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.551 0.691 . . . . 0.0 111.119 -177.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 4.2 p -77.19 -41.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.599 0.714 . . . . 0.0 112.453 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.7 -40.22 63.78 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 710' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 0.9 OUTLIER -101.93 -21.34 14.55 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -175.842 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.08 170.93 12.78 Favored Glycine 0 N--CA 1.474 1.169 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -131.79 -53.93 1.0 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.03 -0.688 . . . . 0.0 111.86 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.484 ' HA ' HG21 ' B' ' 708' ' ' VAL . 51.5 p -90.35 152.26 45.39 Favored Pre-proline 0 C--O 1.232 0.144 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.748 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -35.89 98.59 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.397 2.064 . . . . 0.0 111.63 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.3 16.21 0.64 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -176.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.472 0.651 0 CA-C-O 121.794 0.807 . . . . 0.0 110.017 178.856 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 122.271 1.034 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -62.32 -26.36 68.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.958 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.03 -19.31 6.7 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.754 -0.591 . . . . 0.0 111.815 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.482 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.4 mtm105 -66.25 -32.84 74.5 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.246 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.55 -37.28 72.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -71.28 -36.57 71.73 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.858 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.1 p -56.82 -25.29 55.59 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.13 -0.356 . . . . 0.0 110.522 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.752 HG13 HD12 ' B' ' 781' ' ' ILE . 0.7 OUTLIER -52.79 -32.42 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.561 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -23.3 62.85 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.265 0.555 . . . . 0.0 111.648 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 tt -72.19 -33.94 68.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.006 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.73 -54.03 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.8 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.694 ' OD1' HD23 ' B' ' 785' ' ' LEU . 9.6 m120 -72.47 -13.89 61.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.759 0.79 . . . . 0.0 110.012 174.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.78 -20.83 41.66 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 121.973 -0.454 . . . . 0.0 112.71 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 2.4 m -58.85 -40.99 85.93 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 117.751 0.776 . . . . 0.0 109.839 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -68.59 -48.17 64.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.608 0.718 . . . . 0.0 109.557 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.1 -35.3 73.18 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.213 0.53 . . . . 0.0 111.291 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.53 ' C ' HD23 ' C' ' 755' ' ' LEU . 8.5 tt -59.65 -45.04 93.22 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.457 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.13 -40.69 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 109.818 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.26 -32.37 71.53 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.75 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -59.07 -39.26 81.55 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.533 -0.729 . . . . 0.0 109.124 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.41 -45.6 65.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.65 0.738 . . . . 0.0 111.509 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.41 -41.66 76.11 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.319 0.581 . . . . 0.0 112.564 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.41 -41.51 69.48 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.6 p -64.47 -45.48 87.19 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.427 HD22 HD11 ' C' ' 771' ' ' LEU . 0.2 OUTLIER -69.24 -55.0 11.84 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.683 -179.823 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.532 ' OG ' HD12 ' C' ' 771' ' ' LEU . 2.3 m -98.85 -43.46 6.74 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 765' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' C' ' 764' ' ' SER . 60.2 tp 85.71 -62.97 0.06 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.128 0.971 . . . . 0.0 110.36 -176.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.2 -74.13 0.46 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.486 -0.759 . . . . 0.0 111.887 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 68.2 m -106.58 159.47 16.16 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.734 -0.603 . . . . 0.0 111.125 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.35 -28.2 67.98 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 110.267 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -60.16 -40.6 90.48 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -30.74 69.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.286 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' OG ' ' C' ' 764' ' ' SER . 9.6 tt -60.3 -30.88 69.77 Favored 'General case' 0 C--N 1.344 0.366 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -39.27 73.93 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -65.51 -36.13 82.91 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.846 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.616 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -58.72 -37.91 77.18 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 121.489 0.662 . . . . 0.0 109.817 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.414 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.8 tp -57.45 -36.41 71.38 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.553 0.692 . . . . 0.0 109.431 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -36.14 64.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.405 0.621 . . . . 0.0 109.677 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 16.0 mt -62.07 -43.46 97.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.724 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.545 ' HA ' HD13 ' A' ' 746' ' ' ILE . 5.0 m -63.52 -45.92 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.917 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.491 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.4 p -64.11 -43.25 95.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.338 0.59 . . . . 0.0 112.109 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -32.15 72.78 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.021 -0.424 . . . . 0.0 112.075 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.66 ' CD1' HD12 ' A' ' 746' ' ' ILE . 79.5 mt -69.46 -43.78 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 O-C-N 121.801 -0.562 . . . . 0.0 111.607 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.491 HG22 ' O ' ' C' ' 779' ' ' THR . 26.8 m -56.06 -38.09 51.76 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 O-C-N 121.361 -0.837 . . . . 0.0 111.426 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 . . . . . 0 CA--C 1.544 0.737 0 O-C-N 121.435 -0.791 . . . . 0.0 111.331 -179.192 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.455 HD13 ' CD2' ' C' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt 55.62 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.538 0.685 . . . . 0.0 110.341 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -175.03 169.54 3.34 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.549 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.3 tt -50.85 -40.05 55.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -68.58 -36.28 78.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.407 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -81.13 -42.64 20.6 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.29 0.567 . . . . 0.0 110.343 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -64.34 -46.31 84.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.07 0.462 . . . . 0.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.96 76.75 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.42 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.4 m -59.72 -33.1 71.19 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.276 0.56 . . . . 0.0 110.833 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.408 HD23 HG23 ' A' ' 676' ' ' THR . 2.7 tp -60.53 -29.82 69.36 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.019 0.438 . . . . 0.0 111.092 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -60.67 -20.71 61.63 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.796 -0.565 . . . . 0.0 111.881 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -81.96 -23.99 35.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.08 0.467 . . . . 0.0 111.287 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -58.12 -43.43 87.22 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.496 0.665 . . . . 0.0 110.609 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.7 t80 56.78 37.5 28.85 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.45 0.643 . . . . 0.0 111.796 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.42 -68.23 0.08 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.633 -0.667 . . . . 0.0 112.026 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.653 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.87 -37.14 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-O 121.533 0.683 . . . . 0.0 111.532 -178.953 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.408 HG23 HD23 ' A' ' 669' ' ' LEU . 9.1 m -51.88 -33.73 37.91 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -62.73 -49.68 74.08 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.338 0.589 . . . . 0.0 109.8 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.814 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.9 t90 -65.07 -43.96 90.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.633 0.73 . . . . 0.0 109.553 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -35.41 80.14 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.003 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -99.92 -12.47 19.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -100.61 -1.3 35.73 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.475 -0.766 . . . . 0.0 111.814 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.9 pt -64.25 -36.75 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 O-C-N 121.918 -0.488 . . . . 0.0 110.822 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -47.28 69.84 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.376 0.608 . . . . 0.0 110.114 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.449 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.8 mp -66.66 -26.18 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 177.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -74.1 -32.4 63.2 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.038 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.66 HG21 HD12 ' B' ' 686' ' ' ILE . 20.1 mm -60.67 -48.74 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 121.153 0.501 . . . . 0.0 110.476 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 72.5 mt -67.19 -36.63 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 121.379 0.609 . . . . 0.0 109.669 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mt -58.69 -37.82 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.72 -41.38 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 690' ' ' GLY . . . . . 0.402 ' O ' HG13 ' A' ' 693' ' ' ILE . . . -58.03 -33.92 70.81 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -67.35 -38.29 84.59 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.886 0.85 . . . . 0.0 110.514 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.474 HD23 HD11 ' C' ' 693' ' ' ILE . 0.3 OUTLIER -59.26 -42.01 90.16 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.463 -177.626 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.427 ' CD1' HD13 ' B' ' 692' ' ' LEU . 1.9 pp -64.95 -41.6 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.589 -0.695 . . . . 0.0 110.386 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.41 -18.36 50.2 Favored Glycine 0 CA--C 1.541 1.703 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.03 -38.24 87.9 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.789 0.804 . . . . 0.0 109.562 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.458 ' HD2' ' N ' ' A' ' 696' ' ' ARG . 7.7 mpt_? -55.58 -28.71 56.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.585 0.754 . . . . 0.0 111.963 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.4 -41.59 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 O-C-N 121.472 -0.767 . . . . 0.0 109.094 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.737 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -67.51 -30.25 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.251 -0.906 . . . . 0.0 110.078 177.272 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.39 -28.65 55.4 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.588 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.1 72.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.5 m -60.97 -37.4 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 121.684 -0.635 . . . . 0.0 109.74 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.02 -44.02 97.6 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.128 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 2.1 p -62.69 -32.53 73.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.898 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.562 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.2 OUTLIER -63.28 -43.82 96.83 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.385 1.088 . . . . 0.0 108.585 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.474 HG22 HD12 ' A' ' 748' ' ' LEU . 93.4 t -66.68 -41.92 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.431 178.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.29 -39.08 91.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.063 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -61.66 -48.68 79.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.104 0.954 . . . . 0.0 111.04 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.417 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -71.71 -44.39 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 122.29 1.043 . . . . 0.0 109.655 -179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -68.24 -20.57 64.82 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.871 -178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -97.11 -21.61 17.25 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.03 -1.044 . . . . 0.0 113.744 -177.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.06 69.98 0.72 Allowed Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.704 -0.622 . . . . 0.0 114.291 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 33.1 -134.73 0.03 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.416 ' CB ' HG21 ' C' ' 708' ' ' VAL . 97.3 p -62.81 159.33 45.75 Favored Pre-proline 0 C--N 1.353 0.752 0 O-C-N 121.166 -0.959 . . . . 0.0 112.01 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.72 105.74 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.189 0 C-N-CA 121.254 1.303 . . . . 0.0 111.504 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.7 pt? -101.34 -20.3 15.26 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.4 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 2.1 t . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 122.116 0.96 . . . . 0.0 109.41 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 122.157 0.98 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -57.93 -25.33 60.76 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.536 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -6.84 0.13 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -177.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 746' ' ' ILE . 9.9 ttm180 -59.71 -45.56 91.78 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.516 ' HA ' HD13 ' C' ' 781' ' ' ILE . 2.4 p30 -59.78 -32.13 70.32 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.662 0.744 . . . . 0.0 109.633 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -71.07 -46.09 62.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 121.487 -0.758 . . . . 0.0 111.075 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 97.3 p -58.27 -31.62 67.61 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.493 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.577 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -65.93 -47.26 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 116.918 -1.515 . . . . 0.0 113.726 -179.2 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 747' ' ' ARG . 0.0 OUTLIER -86.78 -16.66 35.62 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 122.508 2.413 . . . . 0.0 108.597 178.407 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 748' ' ' LEU . 0.6 OUTLIER -56.03 -18.82 10.5 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 172.334 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.544 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 0.4 OUTLIER -55.83 -50.37 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 174.566 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -71.19 -23.1 61.97 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 122.584 1.183 . . . . 0.0 107.965 172.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.19 -18.33 20.28 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.401 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.5 p -56.49 -36.26 68.93 Favored 'General case' 0 C--N 1.344 0.361 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.15 -47.85 84.29 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 176.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.18 74.08 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.427 HD22 HG12 ' A' ' 701' ' ' VAL . 8.9 tt -59.7 -45.3 92.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.453 0.644 . . . . 0.0 110.492 -178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.9 mm -61.62 -33.18 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.31 -30.65 69.69 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.731 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.719 ' CG ' HD13 ' B' ' 715' ' ' LEU . 1.7 m-20 -55.44 -43.43 75.4 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.279 -0.888 . . . . 0.0 109.654 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -70.14 -44.76 68.21 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.315 0.578 . . . . 0.0 111.034 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.83 -35.66 81.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.279 0.561 . . . . 0.0 111.737 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.56 -35.22 65.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.943 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 13.1 t -69.64 -45.58 68.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.446 0.641 . . . . 0.0 111.094 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.726 ' HA ' HD13 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -68.76 -55.16 12.17 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -179.472 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 764' ' ' SER . . . . . 0.428 ' HB3' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -98.91 -49.68 4.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.537 0.684 . . . . 0.0 112.771 -179.256 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 12.0 tp 74.18 -62.2 0.47 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -137.96 134.86 35.42 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 58.67 174.51 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.07 0.462 . . . . 0.0 110.056 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -98.87 -27.04 14.09 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.042 -0.411 . . . . 0.0 111.266 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -52.94 -49.59 65.73 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.586 0.708 . . . . 0.0 110.493 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -56.55 -28.01 59.08 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.279 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.436 HD13 ' CE1' ' A' ' 768' ' ' TYR . 0.9 OUTLIER -57.62 -30.77 65.62 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.794 -0.566 . . . . 0.0 110.514 -176.371 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -62.4 -31.84 72.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.521 0.676 . . . . 0.0 109.291 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.33 -47.82 84.38 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.793 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.726 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.6 tt -58.89 -42.13 88.83 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.548 -179.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.16 -40.13 84.65 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.879 -0.513 . . . . 0.0 112.306 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 776' ' ' LEU . . . . . 0.434 ' O ' HG22 ' A' ' 779' ' ' THR . 60.6 mt -72.03 -37.73 69.67 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.39 -36.67 73.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.71 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.24 -46.38 77.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -63.82 -35.44 80.61 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.763 0.792 . . . . 0.0 110.293 178.065 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 23.7 tpt85 -67.09 -43.39 82.69 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.8 mt -63.59 -41.13 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.312 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 779' ' ' THR . 3.5 m -61.44 -38.67 80.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 121.499 -0.75 . . . . 0.0 110.272 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -61.25 -49.65 76.24 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 111.092 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.14 -44.12 69.53 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.202 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.61 0 CA-C-O 120.862 0.363 . . . . 0.0 111.826 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.679 ' HG ' HD22 ' B' ' 661' ' ' LEU . 4.3 tp . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.679 HD22 ' HG ' ' B' ' 660' ' ' LEU . 1.3 mm? 52.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.954 0.883 . . . . 0.0 111.056 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -171.43 -176.68 1.9 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.469 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.618 HD12 HD13 ' C' ' 660' ' ' LEU . 0.7 OUTLIER -53.52 -43.84 68.67 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.812 0.815 . . . . 0.0 110.105 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -71.69 -31.48 66.82 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.355 -0.838 . . . . 0.0 112.537 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -44.94 21.2 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.316 0.579 . . . . 0.0 110.918 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -70.62 -42.1 71.38 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.369 0.604 . . . . 0.0 110.654 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.04 -20.92 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.33 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.0 p -65.47 -35.2 80.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.221 0.534 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.42 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -59.67 -31.46 69.57 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.272 0.558 . . . . 0.0 110.931 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -59.88 -24.46 64.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.096 0.474 . . . . 0.0 111.201 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -84.57 -27.72 27.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.264 0.554 . . . . 0.0 111.189 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -60.73 -53.15 60.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.482 0.658 . . . . 0.0 110.67 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.51 41.69 7.19 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.775 0.797 . . . . 0.0 111.538 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -156.68 -63.34 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.631 -0.668 . . . . 0.0 111.371 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.634 HG13 HD23 ' B' ' 679' ' ' LEU . 7.1 tp -68.42 -37.33 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.803 -0.561 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.7 m -52.36 -33.64 43.95 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.141 -0.349 . . . . 0.0 111.501 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 677' ' ' ASN . . . . . 0.404 ' OD1' ' CZ ' ' B' ' 681' ' ' TYR . 43.0 m-20 -62.12 -49.21 76.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.292 0.568 . . . . 0.0 110.166 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.645 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.6 t90 -65.62 -44.24 87.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 121.749 0.785 . . . . 0.0 109.814 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.634 HD23 HG13 ' B' ' 675' ' ' ILE . 3.7 mm? -64.78 -35.29 80.62 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -94.39 -34.81 12.62 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 681' ' ' TYR . . . . . 0.404 ' CZ ' ' OD1' ' B' ' 677' ' ' ASN . 20.7 m-30 -71.2 -20.95 62.21 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.928 -0.483 . . . . 0.0 111.77 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.775 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.6 -36.43 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 121.9 -0.5 . . . . 0.0 110.224 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 683' ' ' ARG . . . . . 0.775 ' N ' HD12 ' B' ' 682' ' ' ILE . 9.3 ttt-85 -54.52 -47.47 73.07 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.015 0.436 . . . . 0.0 110.875 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.438 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -69.04 -37.16 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.463 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.0 -30.43 69.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.427 -179.091 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.66 HD12 HG21 ' A' ' 686' ' ' ILE . 13.8 mm -60.62 -48.78 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 121.877 -0.515 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 81.4 mt -61.71 -42.24 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.09 -37.74 69.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 685' ' ' PHE . 68.5 t -56.22 -39.87 62.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.06 -27.16 68.41 Favored Glycine 0 CA--C 1.543 1.815 0 O-C-N 121.759 -0.588 . . . . 0.0 112.083 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.8 m -64.69 -45.89 84.69 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.621 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.41 -33.08 70.8 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -175.887 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.683 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -60.06 -41.5 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.23 -0.919 . . . . 0.0 109.278 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.545 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.2 -29.7 71.9 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 177.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.576 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -60.35 -37.62 81.24 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.943 0.877 . . . . 0.0 110.056 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 23.8 mmt180 -55.35 -27.42 47.18 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.206 1.188 . . . . 0.0 114.206 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.545 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.0 tp -58.0 -36.22 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 120.623 -1.298 . . . . 0.0 109.796 -176.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.576 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.0 p -66.67 -30.98 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.586 -0.696 . . . . 0.0 109.577 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.3 m-85 -56.6 -30.59 63.41 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.52 76.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.402 ' O ' HG23 ' B' ' 705' ' ' VAL . 0.5 OUTLIER -65.85 -40.81 88.63 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.3 tp -57.39 -37.97 73.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.123 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 48.0 m -64.12 -41.44 97.23 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.884 0.849 . . . . 0.0 109.885 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -43.58 98.41 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 122.162 0.982 . . . . 0.0 109.124 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 701' ' ' VAL . 97.9 t -67.51 -40.83 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.165 -0.925 . . . . 0.0 108.878 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.452 ' ND2' ' OE1' ' B' ' 710' ' ' GLN . 2.2 m120 -62.69 -36.76 83.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.072 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.562 ' NH2' HD22 ' A' ' 704' ' ' LEU . 63.0 mtt-85 -61.94 -47.21 85.9 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 122.263 1.03 . . . . 0.0 109.931 -179.196 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.524 HG21 ' HA ' ' C' ' 713' ' ' SER . 3.7 t -76.95 -45.55 30.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.727 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -37.96 65.11 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.368 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.629 ' O ' HD12 ' B' ' 715' ' ' LEU . 0.0 OUTLIER -101.95 -22.09 14.38 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.124 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 110.08 146.5 11.16 Favored Glycine 0 CA--C 1.53 1.006 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -89.5 -60.55 1.91 Allowed 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.09 -0.653 . . . . 0.0 112.339 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.71 159.31 85.65 Favored Pre-proline 0 CA--C 1.538 0.513 0 O-C-N 121.516 -0.74 . . . . 0.0 109.33 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.43 ' HB3' HD23 ' A' ' 748' ' ' LEU . 43.3 Cg_exo -27.47 139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.931 2.421 . . . . 0.0 114.26 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.719 HD13 ' CG ' ' A' ' 758' ' ' ASP . 8.7 tt -106.22 -20.46 13.39 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 122.396 1.093 . . . . 0.0 111.814 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 122.095 0.95 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -57.99 -26.64 62.61 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.262 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -13.58 1.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.811 -0.556 . . . . 0.0 112.264 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.53 ' HE ' HD12 ' A' ' 774' ' ' LEU . 51.4 mtm-85 -66.01 -46.29 78.47 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.498 -0.751 . . . . 0.0 110.915 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -30.97 67.57 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.728 -0.607 . . . . 0.0 109.588 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -48.87 51.82 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.416 0.627 . . . . 0.0 109.716 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.3 p -58.35 -44.43 88.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 122.111 -0.368 . . . . 0.0 110.643 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.66 -20.16 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.49 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -59.43 -33.69 71.57 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.6 ' O ' HD23 ' B' ' 748' ' ' LEU . 0.9 OUTLIER -58.67 -16.28 15.57 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 22.3 t -55.96 -53.8 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -72.04 -24.73 61.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.067 175.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.2 -20.6 36.32 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.236 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 2.3 m -58.99 -40.6 85.34 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 121.99 -0.712 . . . . 0.0 109.238 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.9 tp -65.7 -51.15 61.62 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.401 0.62 . . . . 0.0 109.378 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.65 -35.17 75.55 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.187 0.518 . . . . 0.0 111.345 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.43 -45.23 92.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.173 0.511 . . . . 0.0 110.891 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.02 -37.64 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -68.82 -30.34 68.87 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.301 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' C' ' 715' ' ' LEU . 68.1 m-20 -55.25 -49.32 72.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.346 -0.846 . . . . 0.0 110.27 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.42 -41.09 73.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.723 0.773 . . . . 0.0 110.567 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -36.23 83.45 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.198 -178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.1 -50.28 9.24 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.256 0.55 . . . . 0.0 111.775 -178.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 61.6 m -61.81 -46.09 91.02 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.825 0.821 . . . . 0.0 111.116 -178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.502 ' O ' HD13 ' B' ' 774' ' ' LEU . 8.4 tt -69.02 -53.67 19.26 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' B' ' 771' ' ' LEU . 1.2 m -97.73 -39.43 9.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -176.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 765' ' ' LEU . . . . . 0.544 HD13 HD11 ' B' ' 774' ' ' LEU . 0.5 OUTLIER 81.8 -167.59 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -177.284 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -38.37 -66.88 0.23 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 9.5 t -114.82 168.96 9.44 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.606 0.717 . . . . 0.0 111.713 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.92 -17.64 62.08 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.114 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -38.94 91.94 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -67.86 -29.91 69.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.744 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' B' ' 764' ' ' SER . 6.6 tt -59.79 -34.62 73.27 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 122.023 -0.423 . . . . 0.0 109.961 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 40.6 mmm-85 -61.19 -37.95 84.81 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.94 -43.64 74.66 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.283 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.544 HD11 HD13 ' B' ' 765' ' ' LEU . 9.3 mt -66.99 -38.21 85.61 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.752 0.787 . . . . 0.0 110.584 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.695 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -66.91 -38.62 86.57 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.022 -179.762 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.42 -41.65 60.53 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.554 -0.716 . . . . 0.0 111.567 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 777' ' ' ILE . . . . . 0.575 HD12 ' N ' ' B' ' 778' ' ' VAL . 2.7 pp -68.19 -37.09 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 120.524 -0.471 . . . . 0.0 110.501 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.575 ' N ' HD12 ' B' ' 777' ' ' ILE . 0.7 OUTLIER -55.56 -45.5 78.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.655 -0.653 . . . . 0.0 109.328 -179.296 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.818 ' O ' HG22 ' B' ' 782' ' ' VAL . 29.7 p -64.46 -42.13 96.11 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 111.395 178.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -31.82 72.37 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.433 ' HB ' HG21 ' C' ' 746' ' ' ILE . 79.3 mt -61.07 -36.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.818 HG22 ' O ' ' B' ' 779' ' ' THR . 11.4 m -54.16 -37.4 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.413 -0.805 . . . . 0.0 110.043 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -54.31 -46.32 72.77 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.528 0.68 . . . . 0.0 110.505 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.23 -44.32 84.12 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.051 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' C' ' 747' ' ' ARG . 5.1 tp -71.77 -23.91 61.66 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.183 0.516 . . . . 0.0 111.129 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.86 -41.45 20.58 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.49 128.94 33.99 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.603 0.716 . . . . 0.0 110.462 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.071 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.618 HD13 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 121.592 0.71 . . . . 0.0 109.218 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 49.3 mt 59.96 113.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.46 0.648 . . . . 0.0 110.9 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -172.88 170.44 4.55 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.881 0.848 . . . . 0.0 110.524 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.67 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -55.49 -53.97 49.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.466 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.67 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.4 t70 -72.7 -15.74 61.68 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.775 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.06 -42.57 31.85 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.141 0.496 . . . . 0.0 110.896 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -69.2 -46.14 68.17 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.461 0.648 . . . . 0.0 110.949 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.66 -27.84 66.73 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.652 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 32.8 t -63.23 -26.49 68.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.138 0.494 . . . . 0.0 111.694 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -39.75 95.09 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.093 0.473 . . . . 0.0 111.569 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -60.44 -21.17 62.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.017 0.437 . . . . 0.0 111.642 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -79.13 -29.4 43.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.358 0.599 . . . . 0.0 111.093 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -58.45 -52.18 66.71 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.592 0.71 . . . . 0.0 110.51 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.6 t80 58.54 59.9 2.77 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.173 0.987 . . . . 0.0 111.068 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -176.0 -76.26 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.138 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.424 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.4 OUTLIER -67.42 -36.76 77.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-O 121.593 0.711 . . . . 0.0 111.947 -178.658 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 8.0 m -51.41 -32.43 26.33 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -55.79 -43.51 76.89 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.708 -0.62 . . . . 0.0 110.986 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.623 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.68 -44.52 96.79 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.512 0.673 . . . . 0.0 109.863 179.246 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.86 81.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.015 0.436 . . . . 0.0 111.792 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -88.33 -17.87 29.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -101.45 -20.34 15.17 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.687 -0.633 . . . . 0.0 112.121 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.762 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -60.5 -36.68 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 O-C-N 121.784 -0.573 . . . . 0.0 110.904 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.762 ' N ' HD12 ' C' ' 682' ' ' ILE . 5.6 ttt-85 -58.22 -46.74 85.34 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.717 0.77 . . . . 0.0 109.378 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 59.1 mt -71.15 -35.18 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-O 121.391 0.615 . . . . 0.0 109.673 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.52 -31.11 69.09 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.9 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.412 HD12 ' CG2' ' B' ' 686' ' ' ILE . 14.0 mm -61.05 -44.2 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 75.5 mt -62.25 -37.5 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 177.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.17 -40.95 85.01 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 86.7 t -54.97 -43.83 70.88 Favored 'Isoleucine or valine' 0 C--N 1.347 0.471 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.44 -39.2 43.87 Favored Glycine 0 CA--C 1.534 1.23 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.39 -38.88 85.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.307 1.051 . . . . 0.0 109.519 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -61.01 -46.26 91.47 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.474 HD11 HD23 ' A' ' 692' ' ' LEU . 1.3 pp -65.75 -41.57 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.388 0.613 . . . . 0.0 110.157 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.575 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.8 -35.23 89.65 Favored Glycine 0 CA--C 1.535 1.319 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.585 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.0 tt -56.11 -37.62 69.66 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.086 0.946 . . . . 0.0 110.095 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.683 ' HE ' HD11 ' B' ' 693' ' ' ILE . 31.1 mmt180 -55.83 -28.17 55.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.575 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.5 tt -58.28 -35.59 54.21 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 121.158 -0.964 . . . . 0.0 111.082 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.585 HG12 ' O ' ' C' ' 695' ' ' LEU . 10.8 p -54.28 -29.68 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -56.22 -31.14 63.24 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.728 -0.607 . . . . 0.0 110.735 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.07 -37.66 77.62 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.23 -40.91 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.54 -38.34 84.13 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.536 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 43.8 p -64.17 -36.49 84.22 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.286 0.565 . . . . 0.0 110.594 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -43.29 96.8 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 122.174 0.988 . . . . 0.0 108.533 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.94 -45.05 99.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.883 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -62.71 -36.77 84.05 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.407 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.453 ' HG2' ' HB3' ' C' ' 712' ' ' TYR . 0.0 OUTLIER -62.13 -50.22 72.76 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.409 -0.807 . . . . 0.0 110.333 -177.758 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.418 HG12 ' CD1' ' C' ' 748' ' ' LEU . 0.9 OUTLIER -77.57 -44.19 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -177.334 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.06 -44.58 65.49 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -104.1 -22.25 13.45 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.34 173.82 16.09 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 712' ' ' TYR . . . . . 0.453 ' HB3' ' HG2' ' C' ' 707' ' ' ARG . 14.3 p90 -134.49 -58.37 0.83 Allowed 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.6 -0.941 . . . . 0.0 112.628 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.524 ' HA ' HG21 ' B' ' 708' ' ' VAL . 53.1 p -64.19 154.46 82.64 Favored Pre-proline 0 C--N 1.343 0.307 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.574 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -36.41 96.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.806 0 C-N-CA 121.933 1.755 . . . . 0.0 111.554 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.477 HD23 ' OD2' ' B' ' 758' ' ' ASP . 5.8 tp -82.83 16.85 2.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -175.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.009 0.909 . . . . 0.0 109.728 179.134 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 121.824 0.821 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -40.79 95.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.094 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.72 -38.1 77.62 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.063 0.459 . . . . 0.0 111.821 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.501 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.3 ttm-85 -58.3 -36.51 73.44 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.099 -0.376 . . . . 0.0 111.191 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.52 -42.98 88.95 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -71.28 -44.17 65.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.71 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -27.97 58.98 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.36 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -58.15 -14.64 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 747' ' ' ARG . . . . . 0.477 ' HA ' HD22 ' B' ' 785' ' ' LEU . 0.1 OUTLIER -59.45 -25.5 64.42 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 121.315 -0.865 . . . . 0.0 108.783 178.344 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' C' ' 708' ' ' VAL . 0.8 OUTLIER -55.38 -24.71 31.36 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.885 177.849 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.76 -54.03 30.78 Favored 'Isoleucine or valine' 0 C--N 1.349 0.577 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.426 ' CG ' HD23 ' B' ' 785' ' ' LEU . 8.7 m120 -72.54 -22.81 60.96 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.746 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.73 36.05 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.136 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.8 t -58.78 -40.87 85.25 Favored 'General case' 0 C--O 1.234 0.237 0 O-C-N 122.031 -0.688 . . . . 0.0 109.458 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.63 -48.96 67.81 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.371 0.605 . . . . 0.0 110.254 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 754' ' ' ALA . . . . . 0.4 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.89 -35.22 79.94 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 111.86 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.459 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.4 tt -59.26 -45.16 91.95 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 110.74 -178.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 51.1 mt -68.55 -36.36 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 121.502 0.668 . . . . 0.0 109.714 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.66 -30.36 69.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.34 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -55.44 -45.37 76.84 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.737 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -45.18 66.16 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 179.216 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.86 -45.96 69.69 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -67.3 -47.82 69.45 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.3 m -64.07 -45.15 90.02 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.901 0.858 . . . . 0.0 110.58 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.39 -53.31 24.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.0 OUTLIER -98.23 -36.92 9.88 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.044 -1.035 . . . . 0.0 113.309 -177.82 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 765' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' C' ' 766' ' ' PHE . 60.5 mt 65.0 177.68 0.19 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -177.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 766' ' ' PHE . . . . . 0.416 ' C ' ' O ' ' C' ' 765' ' ' LEU . 27.6 t80 -7.01 -66.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -178.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 54.7 p -130.38 172.38 11.93 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.171 0.51 . . . . 0.0 110.676 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.82 -15.73 63.77 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.792 0.33 . . . . 0.0 111.32 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -63.76 -42.16 97.86 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -64.07 -30.33 71.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.801 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' C' ' 764' ' ' SER . 0.8 OUTLIER -60.16 -32.3 70.92 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.953 -0.467 . . . . 0.0 110.015 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 17.3 ttt-85 -62.6 -38.82 91.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -67.7 -43.95 78.88 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.446 HD22 HD12 ' C' ' 777' ' ' ILE . 3.3 mm? -61.39 -37.47 83.54 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.435 ' O ' HG22 ' C' ' 778' ' ' VAL . 1.0 OUTLIER -57.71 -36.26 71.76 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.243 1.021 . . . . 0.0 108.707 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 776' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 776' ' ' LEU . 8.6 tt -74.31 -41.33 61.33 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.704 0.764 . . . . 0.0 109.543 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.728 HG22 HD11 ' C' ' 781' ' ' ILE . 94.3 mt -60.91 -45.63 97.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.87 -179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.493 HG12 HG12 ' A' ' 746' ' ' ILE . 32.7 m -57.74 -39.19 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.57 -0.706 . . . . 0.0 111.102 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.589 ' O ' HG22 ' C' ' 782' ' ' VAL . 7.2 m -63.22 -48.02 80.05 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.629 -0.67 . . . . 0.0 112.065 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -31.81 72.0 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.751 -0.593 . . . . 0.0 111.451 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.728 HD11 HG22 ' C' ' 777' ' ' ILE . 63.4 mt -60.1 -40.22 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.368 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.589 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -53.02 -38.03 28.14 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 CA-C-N 120.185 1.357 . . . . 0.0 109.555 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.553 1.076 0 O-C-N 121.786 -0.571 . . . . 0.0 109.588 178.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.514 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.5 mp 61.57 116.34 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.469 0.652 . . . . 0.0 110.279 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -177.33 173.39 1.74 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.491 0.662 . . . . 0.0 110.086 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -51.68 -43.25 62.66 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.675 0.75 . . . . 0.0 111.118 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.31 -34.89 71.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.752 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.0 mmtt -72.03 -43.08 65.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.178 0.514 . . . . 0.0 111.301 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -67.07 -46.41 74.36 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.133 0.492 . . . . 0.0 110.596 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.44 90.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.376 0.608 . . . . 0.0 111.446 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.26 -33.25 69.18 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.248 0.547 . . . . 0.0 111.085 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.917 HD23 HG23 ' A' ' 676' ' ' THR . 10.9 tp -62.5 -25.57 68.08 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.168 -0.332 . . . . 0.0 111.799 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -61.3 -24.68 66.59 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.736 -0.603 . . . . 0.0 111.127 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -74.87 -31.38 61.6 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.334 0.588 . . . . 0.0 110.858 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 17.7 m95 -55.43 -50.46 69.74 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.683 0.754 . . . . 0.0 109.942 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 17.5 t80 58.7 12.34 2.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -124.98 -60.36 1.36 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.595 -0.691 . . . . 0.0 110.55 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -68.49 -36.66 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.485 0.66 . . . . 0.0 110.751 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.917 HG23 HD23 ' A' ' 669' ' ' LEU . 0.2 OUTLIER -51.72 -33.87 36.49 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -175.663 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -63.7 -49.75 71.88 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.2 0.909 . . . . 0.0 110.253 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.749 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.6 t90 -65.59 -43.85 88.43 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.724 0.773 . . . . 0.0 109.525 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -35.71 81.87 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.8 t90 -101.64 -17.84 16.14 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -92.41 -8.21 45.45 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.432 -0.792 . . . . 0.0 112.053 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.749 HG23 ' O ' ' A' ' 678' ' ' TRP . 5.3 pt -61.06 -36.96 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.708 -0.62 . . . . 0.0 111.002 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.88 -47.44 71.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.946 0.403 . . . . 0.0 110.578 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.0 mp -70.71 -33.45 52.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 177.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.503 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.5 OUTLIER -59.81 -32.48 70.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.892 -179.767 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.968 HD12 HG21 ' C' ' 686' ' ' ILE . 11.0 mm -62.68 -43.25 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-O 121.526 0.679 . . . . 0.0 109.19 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 54.5 mt -66.65 -41.23 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.99 -38.27 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 685' ' ' PHE . 78.7 t -56.99 -41.03 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 177.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 690' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -58.31 -39.26 92.38 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 177.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -61.22 -38.9 88.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.318 1.056 . . . . 0.0 109.663 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.56 -46.1 91.46 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.791 -178.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.635 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -58.04 -42.2 82.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.128 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.72 -36.54 92.87 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.466 ' O ' HD23 ' A' ' 695' ' ' LEU . 2.8 tt -59.57 -41.88 91.2 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.835 0.826 . . . . 0.0 110.146 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.476 ' HG3' HD13 ' C' ' 693' ' ' ILE . 30.8 mmt180 -56.12 -28.55 58.3 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 49.1 mm -58.96 -35.68 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.52 -0.738 . . . . 0.0 110.831 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 4.1 p -53.98 -29.56 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 O-C-N 121.436 -0.79 . . . . 0.0 110.126 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -55.65 -30.85 61.71 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.843 -0.536 . . . . 0.0 110.41 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.72 77.44 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.21 -41.17 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.25 -36.98 76.45 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.746 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 703' ' ' SER . . . . . 0.429 ' HA ' ' HB2' ' A' ' 706' ' ' ASN . 0.9 OUTLIER -61.98 -41.66 98.28 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.358 0.599 . . . . 0.0 110.507 -178.308 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 704' ' ' LEU . 0.8 OUTLIER -60.94 -40.91 95.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 122.026 0.917 . . . . 0.0 108.982 178.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -68.33 -41.82 83.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.914 0.864 . . . . 0.0 108.908 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 706' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 703' ' ' SER . 2.3 m120 -62.72 -45.01 94.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -61.08 -39.33 89.5 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.815 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.9 -44.48 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 122.246 1.022 . . . . 0.0 108.824 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -69.56 -16.81 63.49 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.595 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -93.84 7.75 43.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.494 -0.754 . . . . 0.0 112.644 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 71.83 42.7 52.57 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 110.121 -1.191 . . . . 0.0 110.121 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.55 -167.47 0.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.117 0.961 . . . . 0.0 109.935 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.548 ' OG ' HG23 ' C' ' 708' ' ' VAL . 16.8 p -62.72 160.35 36.66 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.671 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.416 ' CG ' HD12 ' C' ' 748' ' ' LEU . 10.7 Cg_exo -24.34 100.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 123.86 3.04 . . . . 0.0 115.608 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.667 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.3 pt? -109.55 -20.26 12.93 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.336 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 123.068 1.414 . . . . 0.0 109.863 -178.527 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 124.244 1.973 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.38 -25.24 59.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 113.64 -1.618 . . . . 0.0 112.486 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -54.21 -30.27 49.33 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.567 ' O ' HD12 ' A' ' 746' ' ' ILE . 2.4 ttp180 -61.12 -42.68 98.98 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.406 -0.809 . . . . 0.0 110.775 178.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.93 -44.34 91.33 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.799 0.809 . . . . 0.0 110.02 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -36.89 72.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 745' ' ' SER . . . . . 0.449 ' HA ' HD23 ' A' ' 748' ' ' LEU . 42.9 p -64.58 -28.17 69.45 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.786 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.567 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.9 OUTLIER -74.0 -47.1 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.695 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.532 ' O ' ' HG3' ' A' ' 747' ' ' ARG 0.28 9.4 ttt180 -71.9 0.73 8.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.763 -178.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.538 HD21 ' CG ' ' B' ' 714' ' ' PRO . 1.1 mm? -55.71 -16.61 4.48 Favored 'General case' 0 C--N 1.375 1.691 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 168.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.313 1.4 t -53.52 -54.77 16.64 Favored 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.829 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.406 ' HB2' ' HG3' ' A' ' 747' ' ' ARG . 5.4 m120 -73.52 -28.38 61.86 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.261 174.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.15 -20.49 35.57 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.528 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 81.2 p -58.23 -37.58 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.741 0.77 . . . . 0.0 109.187 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 38.1 tp -66.75 -51.14 59.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.185 0.517 . . . . 0.0 109.748 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.62 -35.07 79.3 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.226 0.536 . . . . 0.0 112.106 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.492 HD21 ' NE2' ' B' ' 710' ' ' GLN . 4.7 tt -59.18 -45.36 91.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.977 0.417 . . . . 0.0 111.411 -177.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.4 mt -65.41 -31.88 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 121.335 0.588 . . . . 0.0 109.862 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.54 -30.74 68.63 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 122.049 -0.407 . . . . 0.0 111.799 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -55.67 -46.59 77.53 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.586 -0.696 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -43.32 70.09 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.461 0.648 . . . . 0.0 110.899 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 763' ' ' LEU . 7.2 mt -60.99 -33.36 73.11 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.253 0.549 . . . . 0.0 111.463 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 761' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 765' ' ' LEU . 71.6 mtt180 -82.33 -22.15 35.72 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.4 m -75.3 -46.68 31.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 120.959 -1.088 . . . . 0.0 112.299 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.452 HD11 ' HA ' ' A' ' 760' ' ' LEU . 0.1 OUTLIER -69.65 -53.72 17.34 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -41.49 8.2 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.411 ' HA ' ' O ' ' A' ' 761' ' ' ARG . 1.2 tt 92.1 -64.58 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.212 1.005 . . . . 0.0 111.787 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -151.2 25.08 0.72 Allowed 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.616 -0.677 . . . . 0.0 112.732 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 18.9 p -176.34 138.33 0.31 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.596 -0.69 . . . . 0.0 110.818 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.86 -5.34 25.12 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.861 0.362 . . . . 0.0 111.46 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -82.83 -38.6 22.82 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -61.31 -30.28 70.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.258 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.98 -33.42 71.92 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.043 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -57.03 -38.06 72.62 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.28 -38.13 78.2 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.639 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.538 ' C ' HD13 ' A' ' 774' ' ' LEU . 2.8 tm? -58.19 -39.57 79.28 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 121.302 0.572 . . . . 0.0 109.805 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.65 -36.2 80.12 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.547 0.689 . . . . 0.0 110.783 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -45.36 52.5 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.962 0.41 . . . . 0.0 111.161 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.796 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -69.94 -37.59 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 122.046 -0.409 . . . . 0.0 110.076 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.796 ' N ' HD13 ' A' ' 777' ' ' ILE . 13.4 p -61.64 -42.87 95.87 Favored 'Isoleucine or valine' 0 C--N 1.348 0.54 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.848 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.1 m -64.21 -35.84 82.13 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.306 0.574 . . . . 0.0 110.33 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 780' ' ' ARG . . . . . 0.692 ' NH2' HD21 ' A' ' 784' ' ' LEU . 0.7 OUTLIER -63.67 -37.65 88.14 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.611 HG21 HG23 ' B' ' 746' ' ' ILE . 72.8 mt -54.01 -39.71 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 121.796 -0.565 . . . . 0.0 111.342 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.848 HG22 ' O ' ' A' ' 779' ' ' THR . 6.8 m -54.76 -35.75 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 120.933 0.397 . . . . 0.0 111.041 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -53.81 -51.12 64.51 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -176.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.692 HD21 ' NH2' ' A' ' 780' ' ' ARG . 0.0 OUTLIER -70.59 -32.98 70.55 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.032 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.47 0.538 0 O-C-N 121.751 -0.593 . . . . 0.0 111.94 -178.021 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.51 HD12 ' N ' ' B' ' 660' ' ' LEU . 6.5 mp . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.707 0.765 . . . . 0.0 109.115 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.468 HD12 ' N ' ' B' ' 661' ' ' LEU . 7.9 mp 45.5 90.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.556 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.76 52.42 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 122.112 0.958 . . . . 0.0 111.409 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.623 ' CD1' HD22 ' C' ' 660' ' ' LEU . 13.6 tp 77.77 -46.45 0.46 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.275 1.03 . . . . 0.0 110.151 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -34.29 72.12 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.438 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.64 -41.38 27.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.825 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -75.19 -42.4 55.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.04 0.448 . . . . 0.0 111.742 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.96 -29.69 64.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.393 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.5 m -62.43 -33.79 75.49 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.084 0.468 . . . . 0.0 111.195 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -27.19 68.93 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.027 0.441 . . . . 0.0 111.588 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.0 m95 -59.79 -32.62 70.79 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.156 0.503 . . . . 0.0 111.002 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -69.6 -27.86 65.46 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.105 0.479 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -67.86 -61.5 1.84 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.513 0.673 . . . . 0.0 110.336 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 11.9 t80 63.53 24.49 14.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -132.64 -82.15 0.49 Allowed 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.446 -0.784 . . . . 0.0 111.23 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.711 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.2 OUTLIER -62.42 -36.04 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.417 0.627 . . . . 0.0 110.611 179.498 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.0 m -50.73 -33.13 21.75 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.02 -0.425 . . . . 0.0 110.749 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 19.7 m-20 -56.48 -49.71 73.86 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' B' ' 682' ' ' ILE . 4.1 t90 -66.06 -43.57 87.04 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.81 0.814 . . . . 0.0 109.357 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 675' ' ' ILE . 0.1 OUTLIER -58.15 -35.15 71.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.064 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -105.55 -33.74 8.0 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -176.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -70.09 -8.71 51.66 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.33 -35.8 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.506 -0.746 . . . . 0.0 111.456 179.542 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -47.3 68.74 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 122.118 -0.364 . . . . 0.0 110.907 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.463 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -68.31 -36.21 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.493 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.6 OUTLIER -59.82 -30.8 69.18 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.246 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.896 HD12 HG21 ' A' ' 686' ' ' ILE . 13.0 mm -60.91 -47.11 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.142 0.496 . . . . 0.0 109.762 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 70.3 mt -61.21 -39.44 82.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' B' ' 685' ' ' PHE . 96.6 mt -58.72 -37.57 66.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 685' ' ' PHE . 96.9 t -56.17 -41.93 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.52 -28.21 59.35 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.2 -37.44 87.49 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.996 0.518 . . . . 0.0 110.975 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.26 -45.83 87.12 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.224 0.535 . . . . 0.0 109.997 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.74 HD11 ' NE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -68.34 -40.25 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 O-C-N 122.174 -0.329 . . . . 0.0 110.945 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.694 ' O ' HD12 ' B' ' 697' ' ' ILE . . . -61.89 -38.44 96.0 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 109.906 -1.278 . . . . 0.0 109.906 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.595 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -64.62 -36.49 84.41 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.411 1.1 . . . . 0.0 110.705 178.62 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.628 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -54.78 -28.57 49.85 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -176.808 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.729 HD13 ' H ' ' B' ' 698' ' ' VAL . 0.1 OUTLIER -58.55 -35.57 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 120.839 -1.163 . . . . 0.0 110.092 -177.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.729 ' H ' HD13 ' B' ' 697' ' ' ILE . 9.9 p -54.34 -30.3 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.263 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -56.7 -31.47 64.51 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 121.96 -0.462 . . . . 0.0 109.859 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.33 -38.38 80.19 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.02 -39.2 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tp -62.0 -36.38 81.34 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.326 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -62.1 -37.18 84.1 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 122.04 -0.413 . . . . 0.0 110.563 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.46 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -63.6 -42.59 98.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 122.215 1.007 . . . . 0.0 108.349 177.582 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.581 HG13 HD13 ' B' ' 748' ' ' LEU . 90.4 t -64.04 -45.39 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.981 0.896 . . . . 0.0 109.05 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.81 -35.84 81.21 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.247 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.46 ' NH2' HD22 ' B' ' 704' ' ' LEU . 1.7 ttm105 -59.2 -50.47 73.89 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.822 -1.174 . . . . 0.0 110.393 -178.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.549 HG21 ' HD2' ' C' ' 714' ' ' PRO . 0.6 OUTLIER -78.59 -45.8 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.87 0.843 . . . . 0.0 112.66 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -74.1 -37.55 64.12 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.047 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.492 ' NE2' HD21 ' A' ' 755' ' ' LEU . 7.5 tt0 -102.07 7.37 41.16 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 711' ' ' GLY . . . . . 0.422 ' HA3' HD13 ' B' ' 715' ' ' LEU . . . 76.65 136.01 0.68 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -77.01 -49.63 14.96 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 122.233 -0.569 . . . . 0.0 110.005 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.02 157.43 33.72 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.538 ' CG ' HD21 ' A' ' 748' ' ' LEU . 31.2 Cg_exo -36.31 108.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.102 1.868 . . . . 0.0 114.039 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.422 HD13 ' HA3' ' B' ' 711' ' ' GLY . 3.1 tp -80.11 13.93 2.09 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 27.8 p . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 -179.503 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 121.366 0.603 . . . . 0.0 111.514 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 -71.21 -26.84 63.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.897 -0.502 . . . . 0.0 111.05 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.46 -18.72 7.61 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.89 -0.506 . . . . 0.0 112.038 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -60.52 -39.68 88.66 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.917 -0.489 . . . . 0.0 111.094 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 743' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' B' ' 746' ' ' ILE . 1.0 OUTLIER -59.48 -34.75 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.946 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 744' ' ' ARG . . . . . 0.4 ' C ' ' HD2' ' B' ' 744' ' ' ARG . 0.7 OUTLIER -71.88 -39.4 69.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.191 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.6 m -56.23 -22.79 31.72 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.577 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.611 HG23 HG21 ' A' ' 781' ' ' ILE . 0.6 OUTLIER -52.75 -30.53 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.163 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -63.46 -14.13 47.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.418 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.581 HD13 HG13 ' B' ' 705' ' ' VAL . 55.2 mt -56.13 -40.44 73.78 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 178.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 749' ' ' VAL . . . . . 0.446 HG23 ' O ' ' B' ' 746' ' ' ILE . 0.1 OUTLIER -55.13 -54.12 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -176.549 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.53 -16.11 61.77 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.439 0.638 . . . . 0.0 110.582 175.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -58.13 -21.41 46.34 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 4.4 m -64.48 -44.29 91.49 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.958 -0.731 . . . . 0.0 110.341 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 753' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' B' ' 757' ' ' TRP . 17.2 tp -68.23 -45.98 71.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.056 0.932 . . . . 0.0 109.436 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.75 76.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.5 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 755' ' ' LEU . . . . . 0.482 ' C ' HD23 ' B' ' 755' ' ' LEU . 6.8 tt -58.83 -46.3 88.0 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 121.839 -0.538 . . . . 0.0 110.956 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 44.9 pt -76.2 -30.19 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 121.789 0.804 . . . . 0.0 110.575 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 757' ' ' TRP . . . . . 0.447 ' CZ3' HD11 ' B' ' 753' ' ' LEU . 0.2 OUTLIER -69.25 -30.14 68.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.607 -179.663 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.15 -49.46 77.16 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.593 -0.692 . . . . 0.0 109.148 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.37 -45.33 63.11 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.687 0.756 . . . . 0.0 111.205 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 760' ' ' LEU . . . . . 0.492 ' C ' HD13 ' B' ' 760' ' ' LEU . 3.1 tm? -64.25 -41.67 96.85 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.345 0.593 . . . . 0.0 112.279 -177.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -82.1 -21.26 36.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 48.2 t -74.0 -45.65 48.59 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.448 -0.782 . . . . 0.0 112.151 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.663 ' HA ' HD13 ' B' ' 774' ' ' LEU . 5.9 mp -59.88 -54.94 40.32 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.09 -49.62 4.44 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.722 0.773 . . . . 0.0 112.53 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 72.15 120.85 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.656 0.741 . . . . 0.0 109.986 -178.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 15.1 t80 75.21 -69.19 0.18 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.322 0.649 . . . . 0.0 110.809 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 4.8 m -150.93 176.32 11.21 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.858 -0.526 . . . . 0.0 110.796 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.59 -172.31 0.16 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 78.35 -51.97 0.49 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.683 0.754 . . . . 0.0 108.985 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 15.1 tpt85 -56.62 -29.57 62.33 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.187 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -59.59 -31.99 69.97 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.937 -0.477 . . . . 0.0 109.874 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -57.18 -34.97 69.03 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.54 0.686 . . . . 0.0 109.181 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.01 -46.05 79.34 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.663 HD13 ' HA ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.65 -42.69 88.96 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.524 0.678 . . . . 0.0 109.325 179.179 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.656 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.8 tm? -59.03 -39.0 80.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.317 0.58 . . . . 0.0 110.15 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.63 -42.6 77.82 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 122.129 -0.357 . . . . 0.0 111.276 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 52.2 mt -62.89 -41.48 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.584 HG23 ' O ' ' B' ' 774' ' ' LEU . 64.8 t -61.93 -40.36 86.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.152 0.501 . . . . 0.0 110.097 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.544 ' O ' HG22 ' B' ' 782' ' ' VAL . 9.8 m -62.93 -45.84 90.6 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.013 -0.429 . . . . 0.0 112.02 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.96 72.44 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.542 -0.724 . . . . 0.0 111.846 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.492 HD12 HD13 ' C' ' 746' ' ' ILE . 83.5 mt -68.54 -40.18 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.754 -0.591 . . . . 0.0 111.891 -178.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 779' ' ' THR . 19.5 m -56.39 -38.11 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.362 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -63.25 -42.35 99.18 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.745 0.783 . . . . 0.0 109.742 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 22.8 tp -66.91 -41.57 86.9 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.8 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.409 ' HG ' ' CG ' ' C' ' 750' ' ' ASN . 0.0 OUTLIER -65.29 -35.19 80.25 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.102 0.477 . . . . 0.0 110.631 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -30.49 -51.93 0.21 Allowed Glycine 0 CA--C 1.539 1.535 0 C-N-CA 123.366 0.508 . . . . 0.0 113.04 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.59 85.87 2.44 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 122.214 1.007 . . . . 0.0 109.95 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.901 -1.047 . . . . 0.0 111.004 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.623 HD22 ' CD1' ' B' ' 663' ' ' LEU . 3.9 pp . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 121.902 0.858 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.436 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.9 mp -114.59 151.53 33.29 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.322 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -175.46 174.8 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.278 0.561 . . . . 0.0 110.29 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.455 HD23 ' C ' ' C' ' 663' ' ' LEU . 4.5 tt -49.12 -57.1 7.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.681 0.753 . . . . 0.0 111.942 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.81 -20.7 66.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.265 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -79.18 -46.11 18.57 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.068 0.461 . . . . 0.0 110.962 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -58.5 -45.91 87.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.665 0.745 . . . . 0.0 110.288 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.83 -25.61 64.75 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.298 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 p -64.73 -35.64 81.71 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.276 0.56 . . . . 0.0 110.711 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 29.9 mt -59.91 -30.75 69.25 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.184 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.6 -25.5 64.67 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.963 -0.46 . . . . 0.0 110.857 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -77.79 -27.5 50.21 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.116 0.484 . . . . 0.0 111.277 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.34 -40.63 86.96 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.358 0.599 . . . . 0.0 110.515 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 55.63 32.43 19.23 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.299 0.571 . . . . 0.0 110.985 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -151.53 -69.12 0.17 Allowed 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.646 -0.659 . . . . 0.0 111.953 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.647 HD12 ' CE3' ' C' ' 678' ' ' TRP . 1.6 tp -64.91 -37.6 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 121.83 -0.544 . . . . 0.0 112.053 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.4 m -52.51 -43.12 64.89 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.864 -0.523 . . . . 0.0 111.6 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -57.66 -46.45 84.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.659 0.742 . . . . 0.0 110.13 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.647 ' CE3' HD12 ' C' ' 675' ' ' ILE . 4.3 t90 -65.17 -45.1 86.29 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.167 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 47.4 mt -65.75 -38.96 90.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.388 -0.82 . . . . 0.0 112.698 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -84.3 -42.04 16.22 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.891 -0.505 . . . . 0.0 112.171 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -65.81 -30.02 70.59 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.981 -0.449 . . . . 0.0 112.053 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.725 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.6 pp -62.26 -36.86 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 119.89 -0.724 . . . . 0.0 109.304 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.725 ' N ' HD12 ' C' ' 682' ' ' ILE . 17.6 ttt-85 -59.67 -45.2 92.79 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.1 mm -61.35 -42.81 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.339 1.066 . . . . 0.0 108.65 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.494 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.71 -27.4 66.41 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.031 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.968 HG21 HD12 ' A' ' 686' ' ' ILE . 18.6 mm -60.27 -44.27 95.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.4 -37.74 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 38.4 mm -60.24 -39.29 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.494 HG23 ' O ' ' C' ' 685' ' ' PHE . 84.5 t -55.69 -41.26 64.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 690' ' ' GLY . . . . . 0.401 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.08 -40.48 74.23 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.73 -38.23 83.25 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.824 0.821 . . . . 0.0 110.36 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.482 HD23 HD12 ' B' ' 693' ' ' ILE . 3.1 tp -59.42 -46.56 88.36 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' A' ' 696' ' ' ARG . 2.5 pp -61.3 -41.55 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 121.747 -0.596 . . . . 0.0 109.913 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.713 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -61.02 -34.58 88.46 Favored Glycine 0 CA--C 1.533 1.207 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 4.8 tt -60.75 -38.05 83.86 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.267 1.032 . . . . 0.0 110.214 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.74 ' NE ' HD11 ' B' ' 693' ' ' ILE . 22.6 mmt180 -56.37 -28.33 58.85 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.713 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -58.79 -35.34 55.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 O-C-N 121.329 -0.857 . . . . 0.0 111.248 -176.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.9 p -53.72 -30.82 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.259 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -56.73 -31.58 64.68 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.832 -0.542 . . . . 0.0 110.27 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.94 88.63 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -68.92 -40.42 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.99 -37.56 71.82 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 40.0 m -62.39 -35.61 79.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.532 0.682 . . . . 0.0 109.436 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -41.85 99.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 122.343 1.068 . . . . 0.0 108.19 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.55 -45.36 97.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.458 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -62.79 -36.77 84.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.114 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.404 ' HA ' ' O ' ' C' ' 711' ' ' GLY . 3.0 ttm-85 -62.41 -50.45 71.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.507 -0.746 . . . . 0.0 111.645 -176.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.548 HG23 ' OG ' ' A' ' 713' ' ' SER . 0.4 OUTLIER -77.65 -44.34 29.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.497 0.665 . . . . 0.0 111.714 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -74.31 -43.22 57.65 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 710' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' B' ' 755' ' ' LEU . 0.0 OUTLIER -102.46 -22.06 14.13 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -174.866 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 711' ' ' GLY . . . . . 0.404 ' O ' ' HA ' ' C' ' 707' ' ' ARG . . . 135.68 -157.92 23.52 Favored Glycine 0 N--CA 1.478 1.441 0 O-C-N 121.317 -0.864 . . . . 0.0 111.675 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -147.47 -50.84 0.19 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.382 -1.069 . . . . 0.0 112.556 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 73.5 m -107.75 159.68 29.49 Favored Pre-proline 0 N--CA 1.463 0.183 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.33 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 714' ' ' PRO . . . . . 0.549 ' HD2' HG21 ' B' ' 708' ' ' VAL . 24.7 Cg_exo -32.97 97.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.226 1.951 . . . . 0.0 112.636 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' C' ' 716' ' ' SER . 6.1 tp -70.71 -20.0 62.7 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 716' ' ' SER . . . . . 0.496 ' C ' ' O ' ' C' ' 715' ' ' LEU . 2.3 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 122.09 0.947 . . . . 0.0 112.52 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 122.337 1.065 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -61.43 -26.4 67.84 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.934 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -21.3 13.6 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.89 -0.506 . . . . 0.0 111.808 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.414 ' HD2' HD12 ' B' ' 774' ' ' LEU . 31.3 mtm180 -74.28 -30.15 61.98 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.948 -0.47 . . . . 0.0 110.952 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -58.93 -44.27 91.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.564 0.697 . . . . 0.0 109.532 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -71.27 -40.37 70.99 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.213 0.53 . . . . 0.0 110.268 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 2.0 m -58.57 -41.97 86.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.843 0.354 . . . . 0.0 110.364 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.492 HD13 HD12 ' B' ' 781' ' ' ILE . 82.9 mt -58.66 -18.6 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 O-C-N 122.073 -0.392 . . . . 0.0 110.031 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -59.61 -33.3 71.3 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.416 HD12 ' CG ' ' A' ' 714' ' ' PRO . 5.2 tt -58.95 -18.78 36.86 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.579 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 749' ' ' VAL . . . . . 0.449 HG23 ' O ' ' C' ' 746' ' ' ILE . 93.9 t -55.69 -55.0 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.409 ' CG ' ' HG ' ' B' ' 785' ' ' LEU . 7.4 m120 -73.58 -20.19 60.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.017 174.648 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.66 -20.0 30.02 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.193 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 12.6 t -58.21 -37.85 75.62 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.69 -48.78 58.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.66 74.16 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.493 ' C ' HD23 ' C' ' 755' ' ' LEU . 6.9 tt -59.75 -45.55 91.88 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.346 0.593 . . . . 0.0 110.176 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 42.5 mm -66.31 -36.37 77.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.44 0.638 . . . . 0.0 109.632 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.02 -34.12 74.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.03 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 758' ' ' ASP . . . . . 0.441 ' OD1' HD21 ' A' ' 715' ' ' LEU . 54.6 m-20 -56.49 -46.37 80.5 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.979 0.895 . . . . 0.0 109.16 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 759' ' ' ASP . . . . . 0.823 ' O ' HD22 ' C' ' 763' ' ' LEU . 2.9 m-20 -70.4 -45.27 66.29 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.698 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -31.09 69.81 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -80.21 -49.8 11.14 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 11.6 t -65.82 -45.72 81.27 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.823 HD22 ' O ' ' C' ' 759' ' ' ASP . 0.6 OUTLIER -68.31 -37.5 80.66 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -178.142 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.731 ' H ' HD23 ' C' ' 763' ' ' LEU . 83.5 p -98.36 -49.03 4.83 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.621 0.724 . . . . 0.0 111.663 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 2.4 tt 68.4 55.85 0.5 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.454 1.121 . . . . 0.0 109.273 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 766' ' ' PHE . . . . . 0.415 ' C ' ' HG ' ' C' ' 767' ' ' SER . 0.1 OUTLIER 61.11 152.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.451 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 767' ' ' SER . . . . . 0.415 ' HG ' ' C ' ' C' ' 766' ' ' PHE . 0.1 OUTLIER 55.14 116.32 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.548 0.69 . . . . 0.0 111.709 179.899 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -26.63 68.84 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.734 -0.604 . . . . 0.0 110.82 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -65.52 -43.21 90.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.265 1.031 . . . . 0.0 108.293 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -64.72 -29.9 70.9 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.011 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.719 HD12 ' HB3' ' C' ' 764' ' ' SER . 5.0 tt -59.75 -32.21 70.35 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.475 -0.766 . . . . 0.0 110.395 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -38.22 72.78 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.038 -0.414 . . . . 0.0 110.974 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 773' ' ' ASP . . . . . 0.602 ' OD2' HD22 ' C' ' 774' ' ' LEU . 4.9 p30 -68.29 -33.9 75.18 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.286 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.602 HD22 ' OD2' ' C' ' 773' ' ' ASP . 4.0 mm? -60.25 -38.2 82.76 Favored 'General case' 0 C--N 1.353 0.746 0 CA-C-O 121.838 0.827 . . . . 0.0 110.113 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.792 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.2 mm? -58.17 -36.28 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.028 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -32.85 64.49 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.689 -0.632 . . . . 0.0 111.579 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.581 HD12 HD13 ' C' ' 774' ' ' LEU . 8.3 mt -64.87 -37.45 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.356 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.792 HG22 ' O ' ' C' ' 775' ' ' LEU . 4.4 m -55.5 -39.72 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 122.075 -0.391 . . . . 0.0 111.751 -177.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 22.5 m -63.3 -48.21 79.04 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.774 -0.579 . . . . 0.0 110.679 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -31.56 71.98 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.486 0.66 . . . . 0.0 110.486 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.499 HG21 ' HB ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -58.2 -36.62 58.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.579 -179.268 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 747' ' ' ARG . 39.9 t -52.74 -38.82 28.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.579 -0.701 . . . . 0.0 109.148 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 . . . . . 0 CA--C 1.543 0.681 0 O-C-N 121.463 -0.773 . . . . 0.0 111.197 177.613 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 tp . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.424 0.63 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.42 HD22 ' CZ2' ' A' ' 666' ' ' TRP . 23.5 mt 54.37 64.02 1.96 Allowed 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.643 0.735 . . . . 0.0 109.49 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 662' ' ' GLU . . . . . 0.404 ' C ' ' H ' ' A' ' 664' ' ' ASP . 1.5 mm-40 -157.61 73.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.785 HD23 ' N ' ' B' ' 660' ' ' LEU . 2.3 tm? 70.79 -35.4 0.33 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.981 0.912 . . . . 0.0 112.742 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 664' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 662' ' ' GLU . 11.7 t0 -91.56 -37.16 13.28 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.006 0.431 . . . . 0.0 111.758 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -81.38 -31.44 33.3 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.149 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 666' ' ' TRP . . . . . 0.42 ' CZ2' HD22 ' A' ' 661' ' ' LEU . 97.1 m95 -74.46 -39.9 62.23 Favored 'General case' 0 C--N 1.34 0.193 0 O-C-N 121.955 -0.466 . . . . 0.0 111.167 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -76.91 -36.27 56.76 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 57.4 p -58.13 -30.84 66.64 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.165 0.507 . . . . 0.0 110.844 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.514 HD22 ' OG1' ' A' ' 676' ' ' THR . 2.4 mt -63.93 -24.1 67.6 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -64.43 -31.13 72.21 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.83 -0.544 . . . . 0.0 111.107 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -69.45 -30.1 67.94 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.309 0.576 . . . . 0.0 111.032 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -57.48 -48.98 77.77 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.503 0.668 . . . . 0.0 110.374 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 t80 53.96 32.12 14.76 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.72 0.771 . . . . 0.0 110.829 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -146.79 -68.59 0.26 Allowed 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.702 -0.624 . . . . 0.0 111.715 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.665 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.2 OUTLIER -68.16 -39.83 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 CA-C-O 121.418 0.628 . . . . 0.0 111.953 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.514 ' OG1' HD22 ' A' ' 669' ' ' LEU . 17.4 m -52.81 -33.8 50.79 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -62.55 -50.15 72.48 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.874 -0.516 . . . . 0.0 111.783 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.708 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.9 t-105 -65.53 -45.58 82.89 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.649 -0.657 . . . . 0.0 110.379 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.416 HD21 HH11 ' C' ' 683' ' ' ARG . 0.1 OUTLIER -67.22 -35.1 78.87 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -86.29 -11.16 53.0 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.784 -0.573 . . . . 0.0 111.933 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -103.81 -21.87 13.61 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -61.17 -35.46 65.92 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 CA-C-N 120.729 1.604 . . . . 0.0 111.216 179.058 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 16.0 mmm-85 -52.95 -41.52 64.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.799 0.809 . . . . 0.0 109.618 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 88.4 mt -78.52 -40.91 24.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 CA-C-O 122.078 0.942 . . . . 0.0 109.305 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -27.61 68.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.442 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.75 -45.37 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.85 -37.31 71.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.99 -37.55 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.65 -42.7 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 690' ' ' GLY . . . . . 0.458 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -54.74 -38.9 65.41 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.7 m -67.01 -38.85 86.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.697 0.76 . . . . 0.0 109.48 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -46.24 89.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.919 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.687 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.3 OUTLIER -57.9 -41.7 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.837 -179.173 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.93 -31.25 80.18 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.452 ' O ' HG12 ' A' ' 698' ' ' VAL . 2.4 tt -60.03 -40.54 89.69 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.92 0.866 . . . . 0.0 110.031 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.2 mmm180 -55.53 -28.19 53.32 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.88 0.872 . . . . 0.0 112.112 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 45.3 mm -58.05 -35.33 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.52 -0.738 . . . . 0.0 109.624 -177.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.694 ' O ' HG22 ' A' ' 701' ' ' VAL . 3.3 p -54.02 -28.65 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 121.784 -0.572 . . . . 0.0 110.221 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 19.4 m-85 -54.55 -28.48 46.06 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.83 -0.544 . . . . 0.0 110.651 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.94 -37.42 71.49 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.4 m -67.29 -35.95 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -38.2 87.35 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.032 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 69.9 m -67.26 -40.92 86.27 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.248 0.546 . . . . 0.0 109.851 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.776 HD23 ' HD2' ' A' ' 707' ' ' ARG . 13.1 mt -64.91 -42.68 94.53 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-O 121.784 0.802 . . . . 0.0 109.331 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.581 HG23 ' CB ' ' A' ' 748' ' ' LEU . 0.5 OUTLIER -63.56 -41.49 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.948 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 706' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 2.2 m120 -60.93 -44.57 97.04 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.776 ' HD2' HD23 ' A' ' 704' ' ' LEU . 0.0 OUTLIER -64.94 -35.76 82.22 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.853 0.835 . . . . 0.0 110.575 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.0 t -75.59 -45.44 39.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.451 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 709' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -74.89 -14.58 60.67 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 710' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.8 OUTLIER -83.09 6.97 17.25 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.035 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.63 27.8 Favored Glycine 0 CA--C 1.539 1.57 0 O-C-N 122.024 -0.422 . . . . 0.0 113.17 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.6 -143.41 0.45 Allowed 'General case' 0 CA--C 1.56 1.351 0 O-C-N 121.738 -0.86 . . . . 0.0 110.435 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.468 ' HB2' HG21 ' C' ' 708' ' ' VAL . 81.7 p -62.12 159.7 36.32 Favored Pre-proline 0 C--N 1.351 0.667 0 O-C-N 121.293 -0.88 . . . . 0.0 110.682 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -41.57 104.56 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.585 1.523 . . . . 0.0 112.576 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.611 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.1 pt? -108.82 -20.57 13.02 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -177.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 121.536 0.684 . . . . 0.0 110.682 -179.442 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.311 1.053 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -57.93 -25.09 60.44 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.873 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.34 -9.86 0.33 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -175.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.65 -31.86 70.19 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.366 -0.834 . . . . 0.0 109.151 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -69.59 -45.06 69.5 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -71.11 -31.8 68.22 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.839 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 84.2 p -61.31 -42.57 98.89 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.718 HG22 HD13 ' C' ' 781' ' ' ILE . 48.3 mt -57.65 -16.49 5.81 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -58.46 -25.28 62.09 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.96 -1.088 . . . . 0.0 108.87 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 748' ' ' LEU . 0.5 OUTLIER -60.49 -14.76 21.32 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -54.33 -54.18 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.725 0 CA-C-N 121.4 1.909 . . . . 0.0 105.882 178.784 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -72.81 -20.43 61.14 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.074 -1.875 . . . . 0.0 110.993 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -57.31 -20.96 38.5 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.04 -178.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 7.2 m -61.46 -40.56 94.95 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.887 -0.772 . . . . 0.0 110.084 179.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.6 -50.87 40.4 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.56 0.695 . . . . 0.0 109.802 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.18 -34.83 78.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.176 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.501 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.4 tt -59.5 -45.44 91.69 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.904 -0.497 . . . . 0.0 110.619 -177.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.0 mm -64.93 -34.8 72.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.725 0.774 . . . . 0.0 109.326 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -33.93 75.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.627 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.444 ' OD1' HD23 ' B' ' 715' ' ' LEU . 3.7 m-20 -57.26 -43.05 82.67 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.353 -0.842 . . . . 0.0 109.343 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -70.35 -44.33 68.38 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.664 0.745 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.522 ' HA ' HD11 ' A' ' 763' ' ' LEU . 12.9 mt -65.08 -32.55 74.31 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.651 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -82.39 -22.55 35.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -46.94 24.44 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.321 -0.862 . . . . 0.0 111.675 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -69.13 -53.4 20.38 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.514 -0.741 . . . . 0.0 111.899 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 764' ' ' SER . . . . . 0.471 ' H ' HD12 ' A' ' 763' ' ' LEU . 10.0 p -97.79 -49.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.482 -0.761 . . . . 0.0 112.454 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.449 ' O ' HD23 ' A' ' 765' ' ' LEU . 0.6 OUTLIER 75.94 -7.64 1.77 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.984 0.514 . . . . 0.0 111.036 -178.001 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -174.95 121.42 0.22 Allowed 'General case' 0 C--N 1.347 0.493 0 O-C-N 121.346 -0.846 . . . . 0.0 110.985 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 67.1 m 48.96 -96.71 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.402 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.781 ' CE1' HD23 ' A' ' 771' ' ' LEU . 21.7 t80 -166.68 -21.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.243 -0.911 . . . . 0.0 112.252 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -52.43 -37.44 56.8 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.406 0.622 . . . . 0.0 110.385 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -70.31 -30.59 67.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.372 0.606 . . . . 0.0 111.029 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.781 HD23 ' CE1' ' A' ' 768' ' ' TYR . 0.2 OUTLIER -60.61 -34.2 73.88 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.234 0.54 . . . . 0.0 109.926 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 -41.78 77.87 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -65.76 -34.48 78.27 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.976 HD22 HD11 ' A' ' 777' ' ' ILE . 0.4 OUTLIER -58.24 -38.81 77.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.337 0.589 . . . . 0.0 110.489 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 775' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 778' ' ' VAL . 6.6 tp -59.52 -36.96 77.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.235 0.54 . . . . 0.0 112.239 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 776' ' ' LEU . . . . . 0.519 ' C ' HD13 ' A' ' 776' ' ' LEU . 2.4 tm? -74.69 -42.45 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.631 -0.668 . . . . 0.0 111.634 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.976 HD11 HD22 ' A' ' 774' ' ' LEU . 29.2 pt -65.21 -35.93 76.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.502 ' O ' ' HB ' ' A' ' 781' ' ' ILE . 17.5 m -54.55 -38.95 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.954 0.797 . . . . 0.0 110.171 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 17.8 p -63.07 -35.91 81.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 118.447 -1.301 . . . . 0.0 108.041 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -32.01 72.31 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.681 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 746' ' ' ILE . 0.7 OUTLIER -57.54 -55.7 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.4 m -64.35 -38.89 83.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.594 0.711 . . . . 0.0 111.066 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.15 -41.64 97.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.602 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.91 -43.42 83.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.223 0.535 . . . . 0.0 111.231 -178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.442 HD23 ' OD1' ' B' ' 750' ' ' ASN . 2.0 tp . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 120.966 0.412 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.785 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.6 tp . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.453 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.9 mm? 58.05 106.31 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.315 0.579 . . . . 0.0 110.196 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.15 177.97 4.6 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.939 0.876 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.498 ' C ' HD23 ' B' ' 663' ' ' LEU . 10.1 tt -46.19 -53.76 9.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.691 0.758 . . . . 0.0 111.48 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -65.41 -29.61 70.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.578 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -76.45 -44.4 35.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.913 0.387 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -59.08 -46.1 89.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.634 0.73 . . . . 0.0 110.085 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.08 -21.64 66.61 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.228 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 4.9 m -70.35 -36.25 74.09 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.822 -0.549 . . . . 0.0 111.217 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.581 HD12 ' CG2' ' B' ' 675' ' ' ILE . 3.5 mm? -60.74 -23.82 65.24 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.992 -0.443 . . . . 0.0 111.196 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -59.86 -23.02 63.07 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.764 -0.585 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -88.14 -27.73 21.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.123 0.487 . . . . 0.0 111.265 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -57.44 -50.87 71.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.528 0.68 . . . . 0.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.64 29.94 14.99 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.136 0.494 . . . . 0.0 111.269 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -144.11 -61.47 0.39 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.671 -0.643 . . . . 0.0 111.075 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.581 ' CG2' HD12 ' B' ' 669' ' ' LEU . 5.9 tp -67.92 -37.78 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 121.323 0.582 . . . . 0.0 110.33 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.8 m -52.98 -34.55 56.56 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.758 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -69.16 -50.47 47.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.886 -0.509 . . . . 0.0 111.368 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.74 -42.17 95.4 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.0 tp -65.97 -35.74 81.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.94 0.4 . . . . 0.0 110.859 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -101.27 6.56 42.92 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.58 -21.15 9.29 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 121.71 -0.619 . . . . 0.0 110.471 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 tp -62.16 -35.53 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.771 0.796 . . . . 0.0 109.982 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -53.21 -47.36 69.0 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.622 -0.674 . . . . 0.0 109.972 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.443 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.8 mp -69.21 -37.91 76.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 122.246 1.022 . . . . 0.0 108.394 177.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' B' ' 689' ' ' VAL . 11.9 t80 -59.73 -33.89 72.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.674 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.5 ' CG2' HD12 ' C' ' 686' ' ' ILE . 1.4 mp -60.49 -41.98 89.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 86.2 mt -62.41 -36.95 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.15 -37.54 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.529 ' O ' HD11 ' B' ' 692' ' ' LEU . 93.3 t -54.12 -38.79 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 O-C-N 121.723 -0.611 . . . . 0.0 109.447 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.64 -27.15 57.61 Favored Glycine 0 CA--C 1.546 1.995 0 O-C-N 121.902 -0.499 . . . . 0.0 112.078 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.7 m -60.77 -47.12 87.76 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.613 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.7 -32.59 70.65 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.528 -0.733 . . . . 0.0 111.482 -178.004 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.613 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.37 -41.66 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 O-C-N 121.605 -0.684 . . . . 0.0 109.662 -178.527 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.94 -32.17 83.34 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.84 -37.08 63.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.3 1.048 . . . . 0.0 109.345 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.63 ' HG3' HD11 ' A' ' 693' ' ' ILE . 26.6 mmt180 -55.58 -28.28 54.12 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.692 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 79.2 mt -58.77 -36.21 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 O-C-N 121.423 -0.798 . . . . 0.0 108.914 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -30.29 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 O-C-N 121.674 -0.641 . . . . 0.0 110.123 177.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 5.5 m-85 -56.36 -31.01 63.38 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 121.828 -0.545 . . . . 0.0 109.871 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.89 -37.57 76.89 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.86 -40.59 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.167 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 176.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.3 tp -55.6 -37.21 67.82 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.975 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.5 m -62.37 -40.77 97.51 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.178 0.513 . . . . 0.0 110.821 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.78 -41.05 94.79 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.069 0.938 . . . . 0.0 109.265 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.649 ' HA ' HD13 ' B' ' 748' ' ' LEU . 89.8 t -69.68 -43.57 80.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.556 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HB2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.77 -36.41 82.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.078 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -67.19 -47.75 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.151 -0.968 . . . . 0.0 110.375 -178.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.555 ' CG1' HD11 ' B' ' 748' ' ' LEU . 2.6 t -77.12 -46.29 28.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -73.8 -43.17 59.63 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' B' ' 706' ' ' ASN . 31.5 mt-30 -102.01 -21.58 14.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -175.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 711' ' ' GLY . . . . . 0.444 ' HA3' HD11 ' B' ' 715' ' ' LEU . . . 109.43 136.32 7.53 Favored Glycine 0 CA--C 1.534 1.235 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 712' ' ' TYR . . . . . 0.679 ' O ' HD22 ' A' ' 704' ' ' LEU . 2.1 p90 -75.4 -67.89 0.61 Allowed 'General case' 0 CA--C 1.557 1.24 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 1.7 p -65.54 159.6 66.42 Favored Pre-proline 0 N--CA 1.47 0.535 0 O-C-N 120.628 -1.295 . . . . 0.0 110.516 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -37.57 133.11 0.62 Allowed 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.996 1.798 . . . . 0.0 111.847 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.516 HD22 ' N ' ' B' ' 715' ' ' LEU . 2.0 mm? -94.16 -20.35 19.95 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.503 ' C ' ' O ' ' B' ' 715' ' ' LEU . 97.3 p . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 122.279 1.037 . . . . 0.0 112.819 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 121.47 0.653 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -71.03 -26.61 63.18 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.298 0.57 . . . . 0.0 111.284 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -56.23 -7.03 0.31 Allowed 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.447 ' O ' HG13 ' B' ' 746' ' ' ILE . 3.6 ttm180 -55.73 -38.99 70.51 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.515 -0.741 . . . . 0.0 110.912 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -58.54 -43.94 89.45 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.339 0.59 . . . . 0.0 109.664 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -71.42 -39.78 70.87 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.141 0.496 . . . . 0.0 110.468 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.84 -23.76 46.32 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.982 HG23 HG23 ' A' ' 781' ' ' ILE . 48.6 mt -52.43 -32.47 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.36 67.57 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.165 0.507 . . . . 0.0 110.452 179.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.649 HD13 ' HA ' ' B' ' 705' ' ' VAL . 45.4 mt -56.24 -35.7 67.67 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.497 0.555 . . . . 0.0 112.497 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.48 -54.11 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 750' ' ' ASN . . . . . 0.442 ' OD1' HD23 ' A' ' 785' ' ' LEU . 9.2 m120 -72.46 -18.77 61.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.668 0.746 . . . . 0.0 110.073 175.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.4 37.26 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.377 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 83.8 p -59.21 -39.65 83.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 117.787 0.793 . . . . 0.0 110.052 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.0 tp -69.66 -51.17 37.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.8 0.81 . . . . 0.0 109.649 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.13 73.27 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.408 0.623 . . . . 0.0 111.366 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 755' ' ' LEU . . . . . 0.461 ' C ' HD23 ' B' ' 755' ' ' LEU . 10.5 tt -59.76 -45.2 92.97 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 120.976 0.417 . . . . 0.0 110.787 -178.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 53.7 mt -70.4 -33.7 55.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.5 0.667 . . . . 0.0 109.55 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.1 -30.28 68.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.754 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -55.61 -47.97 75.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.409 -0.807 . . . . 0.0 110.086 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -70.73 -45.25 65.22 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.1 mt -69.23 -46.28 67.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.653 0.74 . . . . 0.0 112.535 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -69.06 -40.12 78.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.682 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 15.4 t -63.92 -45.1 90.77 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.911 0.862 . . . . 0.0 110.599 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.612 ' O ' HD22 ' B' ' 774' ' ' LEU . 3.6 tp -63.83 -51.84 62.88 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.872 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.1 -49.23 5.07 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.878 -0.514 . . . . 0.0 111.922 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 765' ' ' LEU . . . . . 0.536 HD13 ' O ' ' B' ' 765' ' ' LEU . 3.4 tm? 69.45 93.54 0.08 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 122.22 1.009 . . . . 0.0 109.81 -178.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 58.6 t80 56.54 -88.51 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.915 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.2 m -67.96 134.76 51.31 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.283 -0.886 . . . . 0.0 111.246 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.6 -33.95 69.46 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.001 0.429 . . . . 0.0 109.981 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -54.46 -38.49 66.43 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.154 0.978 . . . . 0.0 108.956 178.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.85 -29.6 60.12 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.452 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.426 HD11 HD23 ' B' ' 763' ' ' LEU . 7.3 tt -59.25 -41.28 88.39 Favored 'General case' 0 C--N 1.343 0.296 0 O-C-N 121.794 -0.566 . . . . 0.0 109.841 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 772' ' ' ARG . . . . . 0.407 ' O ' HD12 ' B' ' 776' ' ' LEU . 70.8 mtp85 -59.95 -39.47 85.67 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -64.22 -45.65 87.31 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.235 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.612 HD22 ' O ' ' B' ' 763' ' ' LEU . 5.9 mp -66.6 -37.8 85.65 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 121.835 0.826 . . . . 0.0 110.262 178.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.527 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -62.83 -36.65 83.92 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.646 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 776' ' ' LEU . . . . . 0.407 HD12 ' O ' ' B' ' 772' ' ' ARG . 0.3 OUTLIER -73.67 -42.21 61.64 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.848 -0.533 . . . . 0.0 111.996 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 777' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.89 -37.44 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 121.634 -0.666 . . . . 0.0 110.468 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 13.1 p -63.32 -44.99 99.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.886 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.775 ' O ' HG22 ' B' ' 782' ' ' VAL . 7.2 t -64.06 -35.72 81.67 Favored 'General case' 0 C--N 1.351 0.642 0 O-C-N 121.577 -0.702 . . . . 0.0 111.125 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -31.47 71.94 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.983 -0.448 . . . . 0.0 111.622 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 76.5 mt -67.88 -36.78 76.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 O-C-N 121.759 -0.588 . . . . 0.0 110.907 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.775 HG22 ' O ' ' B' ' 779' ' ' THR . 6.9 m -61.07 -39.0 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.852 -0.53 . . . . 0.0 111.984 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.4 -41.58 93.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.628 -0.67 . . . . 0.0 111.043 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.0 -42.17 99.78 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.619 0.723 . . . . 0.0 110.174 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.433 HD23 ' HB3' ' C' ' 750' ' ' ASN . 15.0 tp -82.36 -17.38 45.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.413 0.625 . . . . 0.0 111.624 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.37 -46.09 22.22 Favored Glycine 0 CA--C 1.531 1.074 0 O-C-N 121.797 -0.564 . . . . 0.0 112.16 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 95.5 5.29 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.488 0.661 . . . . 0.0 110.524 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.127 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.499 HD12 ' C ' ' C' ' 660' ' ' LEU . 4.0 pp . . . . . 0 N--CA 1.496 1.827 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.0 143.28 50.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.267 0.556 . . . . 0.0 110.63 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -172.44 176.44 3.3 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.086 0.469 . . . . 0.0 110.05 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 20.7 tp -54.59 -44.0 72.64 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.767 0.794 . . . . 0.0 109.957 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.88 -33.52 76.22 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.778 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -79.19 -40.32 31.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.185 0.517 . . . . 0.0 110.736 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -70.78 -46.33 63.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 110.318 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.72 -22.26 66.59 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.442 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 36.3 t -68.1 -35.56 78.36 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.1 0.476 . . . . 0.0 111.441 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -34.47 73.35 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.117 0.484 . . . . 0.0 111.197 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 64.9 m95 -59.83 -27.93 67.04 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.117 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -77.73 -20.1 54.07 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.081 -0.387 . . . . 0.0 112.033 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -67.46 -45.07 77.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.673 0.749 . . . . 0.0 110.348 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 53.89 29.26 9.6 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.028 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.05 -75.8 0.24 Allowed 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.49 -0.756 . . . . 0.0 112.497 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.674 HD13 ' CZ3' ' C' ' 678' ' ' TRP . 0.6 OUTLIER -68.23 -36.67 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.62 -0.675 . . . . 0.0 111.221 -178.571 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 25.3 m -51.62 -33.09 31.58 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.16 -0.337 . . . . 0.0 110.963 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -56.33 -47.89 77.85 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.674 ' CZ3' HD13 ' C' ' 675' ' ' ILE . 0.0 OUTLIER -64.87 -43.43 92.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 177.789 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.51 ' O ' HD23 ' C' ' 679' ' ' LEU . 0.9 OUTLIER -58.87 -40.14 83.49 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.33 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -97.71 -40.39 8.6 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -69.18 -19.79 63.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.704 -0.623 . . . . 0.0 112.015 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.67 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.2 pp -60.63 -36.7 72.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.67 ' N ' HD12 ' C' ' 682' ' ' ILE . 1.6 ttt-85 -53.69 -45.21 70.29 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 121.861 0.839 . . . . 0.0 109.023 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.3 mm -62.38 -43.13 97.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 122.4 1.095 . . . . 0.0 108.898 177.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.534 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.7 OUTLIER -60.47 -27.59 67.67 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.125 -178.92 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.5 HD12 ' CG2' ' B' ' 686' ' ' ILE . 16.5 mm -60.11 -46.48 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.974 -0.454 . . . . 0.0 109.889 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.02 -41.4 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.511 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.2 mt -59.79 -37.59 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.951 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.534 HG23 ' O ' ' C' ' 685' ' ' PHE . 79.6 t -54.78 -45.32 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.33 -38.76 62.96 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -37.93 84.65 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 122.09 0.948 . . . . 0.0 109.824 177.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.23 -46.29 88.87 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 113.166 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -61.3 -41.82 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.401 -0.812 . . . . 0.0 109.415 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.95 73.15 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.407 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.4 tt -54.87 -37.66 66.55 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.559 -0.965 . . . . 0.0 110.196 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.91 -28.68 57.89 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 -177.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -36.85 62.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-N 121.338 1.881 . . . . 0.0 111.183 -175.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.4 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.8 p -62.55 -30.26 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.448 -0.782 . . . . 0.0 111.014 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -56.29 -31.12 63.36 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.75 -0.594 . . . . 0.0 110.04 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.18 -37.79 78.24 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -43.64 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tp -61.24 -37.71 84.06 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.209 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 61.9 m -62.52 -36.23 81.94 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.374 0.607 . . . . 0.0 110.371 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -62.91 -47.01 85.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.483 1.135 . . . . 0.0 108.494 178.544 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.72 -44.26 98.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.783 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -62.57 -35.79 80.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.281 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -61.32 -50.28 73.59 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.473 -0.767 . . . . 0.0 110.655 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' A' ' 713' ' ' SER . 0.6 OUTLIER -77.33 -45.02 30.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.824 0.821 . . . . 0.0 111.782 -178.557 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -73.83 -33.37 64.12 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -102.17 -15.49 16.65 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -177.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 91.83 133.73 6.12 Favored Glycine 0 CA--C 1.542 1.751 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -87.7 -36.72 17.23 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.764 -0.845 . . . . 0.0 113.102 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.53 149.35 35.65 Favored Pre-proline 0 N--CA 1.469 0.483 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.961 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 714' ' ' PRO . . . . . 0.443 ' CD ' HG21 ' B' ' 708' ' ' VAL . 16.9 Cg_exo -36.71 92.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.501 2.134 . . . . 0.0 112.704 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.97 11.03 1.94 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.492 0.663 . . . . 0.0 110.903 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -72.67 -38.31 67.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.328 0.585 . . . . 0.0 111.528 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.57 -7.49 53.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.493 ' O ' HD12 ' C' ' 746' ' ' ILE . 0.0 OUTLIER -65.87 -35.34 80.38 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.695 -0.628 . . . . 0.0 111.411 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -58.04 -41.19 82.74 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 109.786 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.4 68.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-O 121.214 0.531 . . . . 0.0 110.496 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 745' ' ' SER . . . . . 0.585 ' O ' HD22 ' C' ' 748' ' ' LEU . 83.8 p -67.04 -43.09 83.64 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.637 -0.665 . . . . 0.0 110.178 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.493 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.8 mp -55.43 -23.9 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.945 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -60.01 -15.64 24.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.885 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.585 HD22 ' O ' ' C' ' 745' ' ' SER . 1.5 pt? -55.38 -31.77 62.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.972 -0.455 . . . . 0.0 110.949 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.7 t -55.73 -54.9 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.433 ' HB3' HD23 ' B' ' 785' ' ' LEU . 2.0 p-10 -72.39 -23.63 61.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.766 0.793 . . . . 0.0 109.761 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.75 -21.76 44.74 Favored Glycine 0 C--N 1.342 0.899 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.012 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 19.3 m -63.07 -42.24 99.62 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.943 -0.739 . . . . 0.0 109.894 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.7 tp -69.32 -44.86 70.85 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.422 0.63 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.78 -35.63 79.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.872 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.447 HD11 ' HG ' ' C' ' 704' ' ' LEU . 8.8 tt -61.33 -45.3 95.02 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.216 0.531 . . . . 0.0 111.241 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 44.7 mm -71.67 -40.99 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.118 0.485 . . . . 0.0 110.38 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.56 -41.11 76.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -55.84 -35.89 66.92 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.346 -0.847 . . . . 0.0 110.54 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -70.37 -45.47 66.0 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.762 0.791 . . . . 0.0 111.156 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 20.8 mt -69.61 -46.07 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.676 0.75 . . . . 0.0 112.249 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 761' ' ' ARG . . . . . 0.542 ' O ' HD13 ' C' ' 765' ' ' LEU . 1.5 ttp180 -68.81 -27.5 65.92 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.543 -177.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.9 m -63.96 -43.96 94.22 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.447 0.641 . . . . 0.0 111.173 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.73 -54.66 14.76 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 3.0 p -97.86 -18.26 18.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 765' ' ' LEU . . . . . 0.545 HD22 ' N ' ' C' ' 765' ' ' LEU . 3.3 mm? 49.67 78.86 0.09 Allowed 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.393 -0.817 . . . . 0.0 109.744 -177.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 69.9 t80 65.9 125.0 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.234 1.016 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 23.06 88.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 178.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 768' ' ' TYR . . . . . 0.437 ' CZ ' HD22 ' C' ' 771' ' ' LEU . 1.1 m-85 22.63 -146.72 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.759 1.223 . . . . 0.0 114.028 176.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 74.26 -64.56 0.38 Allowed 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.201 -0.937 . . . . 0.0 109.398 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.26 69.77 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.098 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' C' ' 768' ' ' TYR . 39.1 tp -59.48 -36.93 76.96 Favored 'General case' 0 C--N 1.348 0.543 0 O-C-N 121.803 -0.561 . . . . 0.0 109.731 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -42.96 82.17 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 773' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' C' ' 776' ' ' LEU . 23.6 m-20 -69.38 -34.4 74.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.556 176.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.524 HD13 ' C ' ' C' ' 774' ' ' LEU . 3.3 tm? -61.08 -41.2 96.21 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.749 -0.594 . . . . 0.0 110.868 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.45 -38.3 83.74 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 776' ' ' LEU . . . . . 0.464 HD12 ' N ' ' C' ' 777' ' ' ILE . 3.3 pp -74.01 -28.45 61.45 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.656 -0.652 . . . . 0.0 111.822 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.464 ' N ' HD12 ' C' ' 776' ' ' LEU . 0.6 OUTLIER -69.26 -39.14 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 O-C-N 121.467 -0.77 . . . . 0.0 110.682 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.702 ' O ' HG22 ' C' ' 781' ' ' ILE . 12.3 m -66.36 -46.35 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.877 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.849 ' O ' HG22 ' C' ' 782' ' ' VAL . 9.8 t -64.21 -37.5 87.71 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.974 -0.454 . . . . 0.0 111.815 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.6 72.59 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.148 -0.345 . . . . 0.0 111.567 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.718 HD13 HG22 ' A' ' 746' ' ' ILE . 8.9 tt -55.03 -39.95 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.546 -0.721 . . . . 0.0 111.233 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.849 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -60.16 -38.29 76.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.276 -0.569 . . . . 0.0 111.917 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 CA--C 1.544 0.723 0 O-C-N 121.708 -0.62 . . . . 0.0 111.531 -178.727 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.663 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.5 tp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.755 0.788 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 76.0 mt 52.75 81.03 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.046 0.927 . . . . 0.0 111.209 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.75 177.82 8.44 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.67 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.3 OUTLIER -54.41 -34.38 61.22 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.253 0.549 . . . . 0.0 110.15 179.444 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -75.79 -35.54 60.04 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -80.1 -41.2 26.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.259 0.552 . . . . 0.0 110.676 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -67.96 -43.62 78.62 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.298 0.57 . . . . 0.0 110.281 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.54 -29.52 63.65 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.722 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 36.7 t -69.77 -30.56 68.16 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 110.745 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.423 HD23 HG23 ' A' ' 676' ' ' THR . 17.8 tp -61.02 -31.5 71.13 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.843 0.354 . . . . 0.0 111.173 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.58 -18.3 39.98 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.921 -0.487 . . . . 0.0 111.702 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -84.02 -16.08 45.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.921 -0.487 . . . . 0.0 111.807 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.6 -50.22 74.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.341 0.591 . . . . 0.0 110.88 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 55.3 t80 56.55 44.42 24.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.005 0.907 . . . . 0.0 110.982 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -153.59 -80.61 0.09 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.8 -0.562 . . . . 0.0 110.561 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 11.2 tt -68.13 -35.71 72.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.841 -0.537 . . . . 0.0 111.973 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.423 HG23 HD23 ' A' ' 669' ' ' LEU . 4.1 m -50.22 -33.34 19.13 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -174.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -63.26 -50.42 70.23 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.331 0.969 . . . . 0.0 109.001 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.411 ' CD1' ' C ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -66.07 -44.37 84.72 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.577 0.704 . . . . 0.0 110.123 177.787 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.425 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -63.67 -37.08 86.0 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -92.11 -44.51 8.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -73.38 -0.82 15.89 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.44 -36.37 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 121.296 -0.878 . . . . 0.0 109.622 178.288 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -53.77 -47.58 70.57 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.96 0.41 . . . . 0.0 110.874 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -68.43 -31.98 53.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -33.61 76.19 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 1.036 HD12 HG21 ' C' ' 686' ' ' ILE . 8.9 mm -60.83 -49.51 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 109.991 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.0 mt -61.48 -38.5 80.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.09 -37.16 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.245 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 74.9 t -54.2 -39.65 43.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.7 -41.73 97.6 Favored Glycine 0 CA--C 1.534 1.24 0 N-CA-C 108.961 -1.655 . . . . 0.0 108.961 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -61.77 -37.9 86.04 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.777 0.798 . . . . 0.0 109.766 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.88 -46.09 88.65 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.879 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.624 HG13 HG22 ' B' ' 693' ' ' ILE . 0.3 OUTLIER -68.38 -40.1 81.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.538 179.538 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -26.73 64.07 Favored Glycine 0 CA--C 1.54 1.652 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.41 -37.33 85.39 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.691 1.234 . . . . 0.0 109.332 177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 21.5 mmt180 -55.9 -28.31 56.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.019 -178.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.1 OUTLIER -59.25 -37.12 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.03 -1.043 . . . . 0.0 109.869 -177.225 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.774 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.1 p -67.41 -30.57 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 121.547 -0.721 . . . . 0.0 109.952 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.3 OUTLIER -55.55 -28.79 56.94 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.232 0.539 . . . . 0.0 109.713 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.06 72.01 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.774 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -61.01 -35.93 68.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -38.0 72.81 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.0 m -64.18 -36.7 84.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.748 0.785 . . . . 0.0 109.707 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.569 HD22 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -61.98 -44.11 97.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 122.495 1.14 . . . . 0.0 108.636 178.666 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.888 HG22 HD12 ' A' ' 748' ' ' LEU . 88.0 t -65.45 -42.03 92.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.484 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -62.61 -37.08 84.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.574 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.569 HH22 HD22 ' A' ' 704' ' ' LEU . 21.4 ttm105 -61.59 -46.93 87.77 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.096 0.951 . . . . 0.0 110.334 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.3 t -75.77 -44.04 39.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.15 0.976 . . . . 0.0 109.833 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.88 -14.89 61.58 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -96.5 -20.69 18.2 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.297 -0.877 . . . . 0.0 111.962 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.9 24.96 7.03 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.416 ' CD1' ' CZ ' ' C' ' 707' ' ' ARG . 0.1 OUTLIER 59.07 -103.55 0.17 Allowed 'General case' 0 CA--C 1.562 1.406 0 O-C-N 121.956 -0.732 . . . . 0.0 111.559 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 2.2 p -79.39 159.52 72.2 Favored Pre-proline 0 C--N 1.349 0.558 0 O-C-N 120.931 -1.106 . . . . 0.0 110.013 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.511 ' HD3' HD12 ' C' ' 748' ' ' LEU . 72.2 Cg_exo -41.72 110.82 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.574 1.516 . . . . 0.0 112.514 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.94 -18.97 13.56 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 122.072 -0.392 . . . . 0.0 111.797 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.546 0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 111.044 -179.802 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.77 0.795 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -26.52 62.38 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.69 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -13.48 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.603 HH11 HG21 ' C' ' 777' ' ' ILE . 20.0 ttp-105 -73.79 -46.82 43.08 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.358 -0.839 . . . . 0.0 110.148 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.468 ' O ' HG23 ' C' ' 781' ' ' ILE . 1.3 p30 -62.79 -34.68 77.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 122.52 1.152 . . . . 0.0 109.645 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -37.87 70.34 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.645 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.3 t -70.02 -39.7 75.65 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.626 -0.671 . . . . 0.0 112.654 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.797 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -66.36 -41.26 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-O 116.367 -1.778 . . . . 0.0 115.28 -176.768 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.447 ' HD3' ' HB2' ' A' ' 750' ' ' ASN . 1.6 tmt_? -78.37 -11.51 59.95 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 123.568 2.895 . . . . 0.0 109.212 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.888 HD12 HG22 ' A' ' 705' ' ' VAL . 3.5 tm? -55.78 -20.54 15.32 Favored 'General case' 0 C--N 1.375 1.698 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 172.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.8 p -54.67 -50.41 60.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 177.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.447 ' HB2' ' HD3' ' A' ' 747' ' ' ARG . 4.6 m120 -71.99 -28.17 63.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.522 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.4 -18.65 22.92 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.409 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 77.6 p -56.63 -36.77 69.85 Favored 'General case' 0 C--N 1.347 0.458 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 33.7 tp -61.53 -47.96 83.19 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.74 -34.59 71.54 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.768 178.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.46 HD22 HG12 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -59.01 -44.68 91.72 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.725 -0.61 . . . . 0.0 111.38 -177.414 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.36 -32.63 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.43 -30.67 68.65 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.019 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 4.4 m-20 -58.02 -46.99 84.4 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.94 0.876 . . . . 0.0 108.814 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.71 -42.24 70.86 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.505 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 19.3 mt -68.25 -33.39 74.3 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -70.65 -27.43 64.03 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 762' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 m -75.82 -45.35 36.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.544 0.688 . . . . 0.0 110.819 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.64 ' HA ' HD13 ' A' ' 774' ' ' LEU . 7.0 mp -68.5 -56.79 7.16 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.41 -49.53 4.21 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.085 0.945 . . . . 0.0 112.301 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.467 ' C ' HD13 ' A' ' 765' ' ' LEU . 2.9 tm? 91.32 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.354 1.462 . . . . 0.0 110.626 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -114.11 -68.07 0.95 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.648 -0.657 . . . . 0.0 111.266 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 24.8 p -91.45 158.8 16.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -78.31 -18.26 55.46 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.122 0.487 . . . . 0.0 111.015 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -72.36 -35.3 68.48 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.589 0.709 . . . . 0.0 109.345 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -57.85 -30.02 65.45 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.243 0.544 . . . . 0.0 110.68 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -34.82 73.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -56.84 -37.58 71.47 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.599 0.714 . . . . 0.0 109.582 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.31 -48.58 72.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.83 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.683 HD12 ' NE ' ' B' ' 742' ' ' ARG . 5.8 tt -60.52 -38.48 84.53 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.653 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.59 -36.97 74.83 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.4 -0.813 . . . . 0.0 110.641 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.23 -45.31 48.91 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.99 -0.444 . . . . 0.0 112.069 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.31 -37.25 79.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.685 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.447 HG22 HG12 ' B' ' 746' ' ' ILE . 38.5 t -56.28 -46.79 81.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.795 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.2 p -64.13 -35.37 80.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.606 0.717 . . . . 0.0 109.854 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -65.3 -38.4 90.08 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.129 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.407 ' CD1' HD13 ' B' ' 746' ' ' ILE . 78.4 mt -59.29 -37.07 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 O-C-N 122.078 -0.389 . . . . 0.0 111.399 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.795 HG22 ' O ' ' A' ' 779' ' ' THR . 5.7 m -54.39 -38.34 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 121.331 -0.856 . . . . 0.0 110.431 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -64.57 -42.51 95.61 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.399 0.619 . . . . 0.0 110.768 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.22 -43.94 69.63 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.399 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.461 HD21 ' HG3' ' B' ' 747' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.633 0 O-C-N 121.861 -0.525 . . . . 0.0 111.057 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.67 ' N ' HD12 ' A' ' 663' ' ' LEU . 10.6 mt . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.564 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.4 mm? 60.25 110.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.342 0.591 . . . . 0.0 110.239 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -177.2 169.4 2.29 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.633 HD12 HD13 ' C' ' 660' ' ' LEU . 3.4 tt -51.21 -38.6 53.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.402 0.62 . . . . 0.0 110.552 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -70.96 -37.16 72.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.336 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -70.31 -47.85 59.3 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.364 0.602 . . . . 0.0 110.775 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -60.22 -45.4 93.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.435 0.636 . . . . 0.0 110.182 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.8 -25.68 65.71 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.311 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.29 -37.75 88.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.216 0.531 . . . . 0.0 111.136 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 45.0 mt -60.13 -30.28 69.18 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.015 0.436 . . . . 0.0 111.718 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -59.56 -25.15 64.31 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.211 0.529 . . . . 0.0 110.695 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -81.14 -22.03 39.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.091 0.472 . . . . 0.0 111.328 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -70.01 -49.69 48.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.649 0.737 . . . . 0.0 110.702 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.6 t80 59.78 49.69 7.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.02 0.914 . . . . 0.0 111.031 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -158.21 -70.37 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.867 -0.52 . . . . 0.0 110.855 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.19 -37.18 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.129 0.49 . . . . 0.0 110.912 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.34 -33.74 44.13 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -65.28 -50.86 64.13 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 121.495 -0.753 . . . . 0.0 110.753 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.753 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.2 t90 -65.84 -44.03 86.75 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.854 0.835 . . . . 0.0 109.094 177.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.65 -35.73 81.5 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.25 -28.1 12.83 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -82.6 -6.04 59.13 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.432 -0.792 . . . . 0.0 112.155 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.753 HG23 ' O ' ' B' ' 678' ' ' TRP . 3.3 pt -60.88 -36.74 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.782 -0.574 . . . . 0.0 111.038 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.39 -47.08 69.82 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.075 0.464 . . . . 0.0 110.291 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -68.99 -34.0 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.4 OUTLIER -60.56 -27.62 67.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.38 179.606 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.797 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -60.75 -45.53 97.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.256 0.55 . . . . 0.0 109.537 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 71.6 mt -62.63 -40.87 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' B' ' 685' ' ' PHE . 32.6 mt -58.61 -37.53 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.47 ' O ' HD12 ' B' ' 692' ' ' LEU . 62.8 t -57.77 -43.35 83.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.63 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.71 -26.71 47.4 Favored Glycine 0 CA--C 1.544 1.845 0 O-C-N 121.579 -0.701 . . . . 0.0 111.926 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 18.6 m -60.52 -45.82 92.41 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.47 HD12 ' O ' ' B' ' 689' ' ' VAL . 0.0 OUTLIER -59.62 -32.61 70.58 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 119.674 1.124 . . . . 0.0 111.586 -177.565 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.624 HG22 HG13 ' A' ' 693' ' ' ILE . 0.9 OUTLIER -57.42 -44.98 85.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.579 -0.701 . . . . 0.0 109.628 -178.187 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.09 67.66 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.422 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.8 OUTLIER -60.17 -37.4 80.04 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.018 0.913 . . . . 0.0 110.424 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.5 ' N ' ' HD2' ' B' ' 696' ' ' ARG . 8.4 mpt_? -54.85 -28.48 50.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.077 0.951 . . . . 0.0 113.259 -178.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -36.4 62.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 O-C-N 120.953 -1.092 . . . . 0.0 109.204 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.422 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.25 -30.22 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 121.499 -0.751 . . . . 0.0 110.413 177.379 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 6.6 m-85 -56.29 -31.09 63.33 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 121.861 -0.524 . . . . 0.0 109.861 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.67 77.23 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -42.15 89.63 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.3 tp -58.64 -38.76 78.8 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.423 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -62.92 -35.17 79.21 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.375 0.607 . . . . 0.0 110.414 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -42.32 95.0 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 122.191 0.996 . . . . 0.0 108.965 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.476 HG22 HD13 ' B' ' 748' ' ' LEU . 72.0 t -66.77 -45.17 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 122.192 0.996 . . . . 0.0 108.783 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.458 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.4 m-80 -62.86 -36.43 83.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.419 ' CZ ' ' HG2' ' C' ' 707' ' ' ARG . 23.2 ttm180 -69.0 -50.13 51.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.741 0.781 . . . . 0.0 111.151 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' C' ' 713' ' ' SER . 1.0 OUTLIER -77.95 -44.67 28.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.148 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -59.75 -45.69 91.43 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.597 ' O ' HD12 ' B' ' 715' ' ' LEU . 3.8 pt20 -105.08 -24.11 12.83 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 140.41 164.96 10.11 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -98.5 -65.49 0.96 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.899 -0.765 . . . . 0.0 111.511 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 38.6 p -72.56 159.47 85.28 Favored Pre-proline 0 CA--C 1.532 0.282 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.299 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.593 ' HB3' HD23 ' A' ' 748' ' ' LEU . 38.5 Cg_exo -34.59 125.02 0.19 Allowed 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.269 1.979 . . . . 0.0 113.352 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.597 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.2 tt -87.5 -20.4 26.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.42 ' C ' ' O ' ' B' ' 715' ' ' LEU . 27.2 t . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 122.131 0.967 . . . . 0.0 113.175 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.16 0.981 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -57.93 -26.33 62.1 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.401 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.4 -8.67 0.36 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.683 ' NE ' HD12 ' A' ' 774' ' ' LEU . 4.8 ptt-85 -78.18 -26.65 47.73 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.296 -0.877 . . . . 0.0 111.453 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -58.14 -45.89 86.6 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.97 -0.456 . . . . 0.0 110.095 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.97 -34.76 69.22 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.245 0.545 . . . . 0.0 109.991 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -56.79 -33.7 66.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.357 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.447 HG12 HG22 ' A' ' 778' ' ' VAL . 0.8 OUTLIER -55.63 -17.95 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.37 177.041 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.461 ' HG3' HD21 ' A' ' 785' ' ' LEU . 15.5 ttm180 -58.81 -25.81 63.52 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.507 ' C ' HD12 ' B' ' 748' ' ' LEU . 4.4 pp -55.43 -23.29 24.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.009 0.433 . . . . 0.0 110.593 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 749' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 746' ' ' ILE . 74.7 t -55.41 -53.93 30.62 Favored 'Isoleucine or valine' 0 C--N 1.348 0.537 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 750' ' ' ASN . . . . . 0.451 ' OD1' HD22 ' A' ' 785' ' ' LEU . 8.7 m120 -72.22 -20.11 61.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.355 176.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.45 -20.52 37.91 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 16.3 m -59.04 -41.83 88.8 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 121.871 -0.782 . . . . 0.0 109.804 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -65.78 -50.5 64.48 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.552 0.692 . . . . 0.0 110.09 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.41 -35.4 79.1 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.188 0.518 . . . . 0.0 111.641 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 755' ' ' LEU . . . . . 0.426 HD21 HE22 ' C' ' 710' ' ' GLN . 7.1 tt -59.6 -45.3 92.32 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.909 -0.495 . . . . 0.0 110.857 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 60.0 mt -63.61 -36.56 76.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.808 0.813 . . . . 0.0 108.857 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -30.28 69.13 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.584 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 95.6 m-20 -55.34 -49.4 72.33 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.715 0.769 . . . . 0.0 109.817 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -70.53 -44.69 67.01 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.0 -29.68 70.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -82.05 -45.47 15.23 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -42.68 65.13 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.683 0.754 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.466 HD23 HD11 ' B' ' 771' ' ' LEU . 1.3 tp -60.83 -53.84 52.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.488 -178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.4 p -97.89 -49.48 4.78 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.427 0.632 . . . . 0.0 112.112 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.0 tt 64.9 104.86 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.995 0.902 . . . . 0.0 111.711 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.41 -76.06 0.06 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.84 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 13.3 m -112.78 172.14 7.11 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.429 -0.794 . . . . 0.0 112.071 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -37.54 30.17 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.116 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -53.08 -38.99 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.275 1.036 . . . . 0.0 109.027 178.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 18.7 tpt85 -61.13 -29.76 69.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.007 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.466 HD11 HD23 ' B' ' 763' ' ' LEU . 10.4 tt -59.75 -33.08 71.2 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.854 -0.529 . . . . 0.0 110.537 -178.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -56.66 -32.89 65.82 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -47.67 85.32 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.669 HD12 ' HE ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.723 0.773 . . . . 0.0 110.142 179.657 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.587 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.9 OUTLIER -62.68 -43.07 99.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.085 0.469 . . . . 0.0 111.046 -178.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 65.2 mt -74.01 -41.15 62.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 1.9 pp -70.26 -37.22 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 121.765 -0.585 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.537 HG23 ' O ' ' B' ' 774' ' ' LEU . 40.7 t -61.25 -46.08 97.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.503 -0.748 . . . . 0.0 109.786 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.833 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.0 t -63.77 -41.99 97.87 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 121.766 -0.583 . . . . 0.0 112.085 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -31.86 72.12 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.84 -0.537 . . . . 0.0 111.756 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.73 -36.47 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 122.03 -0.419 . . . . 0.0 110.754 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.833 HG22 ' O ' ' B' ' 779' ' ' THR . 8.9 m -54.06 -38.26 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.572 -0.705 . . . . 0.0 109.908 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -61.22 -41.86 97.6 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.561 0.696 . . . . 0.0 110.425 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.14 -44.06 80.78 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.708 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.723 HD23 ' OD1' ' C' ' 750' ' ' ASN . 27.9 tp -82.88 -13.96 55.15 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.293 0.568 . . . . 0.0 111.351 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.99 -42.41 60.66 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.98 133.19 41.98 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.607 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.633 HD13 HD12 ' B' ' 663' ' ' LEU . 4.3 pp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.43 0.633 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.515 HD22 ' N ' ' C' ' 661' ' ' LEU . 3.3 mm? -113.13 152.6 29.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.344 0.592 . . . . 0.0 109.581 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -167.61 158.11 10.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.319 0.58 . . . . 0.0 109.719 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.663 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -53.18 -53.62 47.88 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 122.135 0.969 . . . . 0.0 109.62 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.581 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -66.76 -18.53 65.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.062 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -81.12 -48.44 12.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.062 0.458 . . . . 0.0 110.495 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.451 ' CZ2' HD12 ' C' ' 661' ' ' LEU . 74.6 m95 -56.6 -46.42 80.88 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.28 0.562 . . . . 0.0 110.338 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.11 -25.67 67.11 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.325 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -35.64 81.54 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 122.077 -0.389 . . . . 0.0 111.463 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.5 -35.92 77.09 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.224 0.535 . . . . 0.0 111.424 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -59.91 -26.74 66.16 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.129 0.49 . . . . 0.0 110.826 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -74.09 -34.38 63.96 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.233 0.54 . . . . 0.0 110.975 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -53.83 -43.64 69.59 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.487 0.66 . . . . 0.0 110.552 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 55.89 41.34 30.12 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.404 0.621 . . . . 0.0 111.165 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -156.67 -72.63 0.1 Allowed 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.724 -0.61 . . . . 0.0 112.18 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.773 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -68.19 -37.6 78.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-O 121.508 0.67 . . . . 0.0 111.684 -178.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.18 -33.65 41.59 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.987 -0.446 . . . . 0.0 112.163 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -56.97 -49.52 75.46 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.592 0.711 . . . . 0.0 110.205 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.678 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.22 -40.79 94.59 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.193 0.52 . . . . 0.0 109.788 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' C' ' 675' ' ' ILE . 13.7 mt -66.07 -38.25 87.82 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -96.02 -18.48 20.19 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.42 -16.06 31.77 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.644 -0.66 . . . . 0.0 111.809 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.678 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.3 pt -62.93 -37.02 78.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.785 -0.572 . . . . 0.0 111.439 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -53.79 -47.38 70.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.611 0.719 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.459 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.92 -36.52 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.74 -32.09 70.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.376 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 1.036 HG21 HD12 ' A' ' 686' ' ' ILE . 9.4 mm -61.16 -47.78 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.168 0.509 . . . . 0.0 109.856 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.4 mt -62.48 -39.86 85.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.206 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.5 mt -58.86 -36.83 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.404 HG23 ' O ' ' C' ' 685' ' ' PHE . 75.8 t -53.98 -40.05 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.8 -41.15 90.66 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.2 m -64.44 -37.8 88.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.656 0.741 . . . . 0.0 109.488 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -59.52 -43.54 93.38 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.262 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.422 ' HB ' HG12 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -68.12 -41.9 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 122.114 -0.366 . . . . 0.0 110.975 -177.514 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.72 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -26.65 65.15 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.626 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.5 tt -67.47 -40.33 85.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.882 0.849 . . . . 0.0 110.376 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -55.65 -28.98 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.72 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -59.31 -35.63 59.23 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.501 -0.75 . . . . 0.0 111.416 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.626 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.9 p -54.1 -29.82 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -55.9 -31.32 62.75 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.793 -0.567 . . . . 0.0 110.303 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.45 81.28 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.08 -41.89 81.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.91 -37.34 79.16 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.568 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 73.5 m -62.64 -39.31 93.44 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.989 0.423 . . . . 0.0 110.765 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -40.91 96.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.868 0.842 . . . . 0.0 108.857 178.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.467 HG22 HD21 ' C' ' 748' ' ' LEU . 98.1 t -62.04 -44.69 99.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -62.23 -35.64 79.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.593 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.419 ' HG2' ' CZ ' ' B' ' 707' ' ' ARG . 2.5 tmm_? -60.07 -50.92 71.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.907 0.86 . . . . 0.0 111.078 -177.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.492 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -77.72 -44.3 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.813 0.816 . . . . 0.0 111.167 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -72.97 -34.71 66.65 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.405 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 710' ' ' GLN . . . . . 0.426 HE22 HD21 ' B' ' 755' ' ' LEU . 8.3 tt0 -102.82 -20.89 14.14 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 115.58 -177.27 17.07 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -128.25 -50.96 1.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.471 ' HA ' HG21 ' B' ' 708' ' ' VAL . 31.6 p -106.78 159.48 29.74 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.356 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -34.06 94.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 122.424 2.082 . . . . 0.0 112.869 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.412 HD23 ' OD2' ' B' ' 758' ' ' ASP . 18.8 tp -81.03 -1.88 45.76 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.958 0.885 . . . . 0.0 113.315 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.797 0.808 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 tpt85 -59.03 -30.5 68.07 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.254 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -56.43 -13.38 2.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.669 ' HE ' HD12 ' B' ' 774' ' ' LEU . 16.8 mtm-85 -75.57 -44.84 41.12 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.565 -0.709 . . . . 0.0 111.468 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.35 -44.36 88.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.188 0.518 . . . . 0.0 109.991 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -36.04 71.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.041 0.448 . . . . 0.0 110.327 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -57.56 -42.86 83.87 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.908 -0.495 . . . . 0.0 110.274 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.546 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.5 mp -53.96 -19.74 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.635 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 747' ' ' ARG . . . . . 0.711 ' HA ' HD22 ' B' ' 785' ' ' LEU . 65.5 mtt180 -59.44 -34.26 72.29 Favored 'General case' 0 C--N 1.343 0.285 0 O-C-N 121.071 -1.018 . . . . 0.0 109.26 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.545 ' O ' HD23 ' C' ' 748' ' ' LEU . 9.6 tt -57.35 -17.64 13.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 749' ' ' VAL . . . . . 0.433 HG12 ' OD1' ' C' ' 750' ' ' ASN . 0.3 OUTLIER -55.84 -53.35 38.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -179.506 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.723 ' OD1' HD23 ' B' ' 785' ' ' LEU . 8.9 m120 -71.89 -18.68 62.03 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.558 0.694 . . . . 0.0 109.568 175.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.27 -20.58 36.8 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.9 p -58.31 -37.9 75.99 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -69.22 -50.34 48.22 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.653 0.74 . . . . 0.0 109.232 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.09 -34.64 72.22 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.935 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.465 ' C ' HD23 ' C' ' 755' ' ' LEU . 7.0 tt -58.71 -45.47 89.48 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.908 -0.495 . . . . 0.0 111.067 -177.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 74.2 mt -68.26 -41.78 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.771 0.796 . . . . 0.0 108.981 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -67.1 -30.68 70.77 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.74 -45.67 92.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.224 -0.923 . . . . 0.0 108.608 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -42.27 72.69 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.595 0.712 . . . . 0.0 110.975 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -42.64 76.63 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 761' ' ' ARG . . . . . 0.442 ' O ' HD12 ' C' ' 765' ' ' LEU . 19.9 mtm180 -74.57 -49.44 21.78 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.062 0.458 . . . . 0.0 111.841 -178.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.6 t -59.77 -45.85 91.0 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.478 -0.764 . . . . 0.0 110.18 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.438 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.2 tt -68.84 -54.15 17.34 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.574 ' CB ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -99.19 -49.63 4.42 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.826 0.822 . . . . 0.0 112.785 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 765' ' ' LEU . . . . . 0.442 HD12 ' O ' ' C' ' 761' ' ' ARG . 0.4 OUTLIER 77.41 -179.53 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.474 0.709 . . . . 0.0 109.368 -177.613 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.99 138.09 6.84 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.476 0.655 . . . . 0.0 111.156 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 m 57.94 165.07 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.5 0.667 . . . . 0.0 111.065 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.32 0.65 43.38 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.402 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -81.62 -44.76 16.76 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 -64.15 -28.36 69.71 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.561 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.574 HD12 ' CB ' ' C' ' 764' ' ' SER . 0.3 OUTLIER -58.18 -30.1 66.16 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.35 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -56.61 -32.88 65.72 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -65.27 -47.32 77.12 Favored 'General case' 0 C--N 1.352 0.693 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.561 HD13 HD12 ' C' ' 777' ' ' ILE . 4.5 mm? -59.2 -37.6 77.86 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.603 0.716 . . . . 0.0 110.319 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.55 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.3 mp -57.68 -36.35 71.82 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.652 0.739 . . . . 0.0 109.909 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.89 -40.42 60.93 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.507 -0.746 . . . . 0.0 110.361 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.603 HG21 HH11 ' A' ' 742' ' ' ARG . 41.9 mt -62.88 -37.37 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 O-C-N 122.252 -0.28 . . . . 0.0 111.618 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.55 HG22 ' O ' ' C' ' 775' ' ' LEU . 29.6 m -55.44 -39.59 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.281 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.7 m -63.47 -40.67 97.72 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-O 121.971 0.891 . . . . 0.0 109.584 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.81 -38.42 86.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.657 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.797 HG21 ' HB ' ' A' ' 746' ' ' ILE . 63.9 mt -60.56 -42.22 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.8 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.402 ' HA ' ' CG ' ' A' ' 747' ' ' ARG . 48.6 t -53.7 -38.33 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.631 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 . . . . . 0 CA--C 1.54 0.586 0 O-C-N 121.93 -0.481 . . . . 0.0 111.358 178.424 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.717 ' N ' HD23 ' C' ' 663' ' ' LEU . 3.5 tp . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 47.3 mt 58.13 104.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.772 0.796 . . . . 0.0 110.834 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -174.65 -171.51 0.57 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.568 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.2 tt -52.69 -41.22 63.67 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.564 -0.71 . . . . 0.0 110.635 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.5 -32.24 66.02 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -77.48 -44.93 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.435 0.636 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -70.46 -44.64 67.33 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.3 0.571 . . . . 0.0 110.847 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.79 65.82 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.524 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 46.3 t -66.92 -34.94 78.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.208 0.528 . . . . 0.0 111.271 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -35.22 74.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.376 0.608 . . . . 0.0 111.079 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.88 -22.79 62.82 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.203 0.525 . . . . 0.0 111.242 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -79.86 -20.81 45.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.247 0.546 . . . . 0.0 111.264 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -71.55 -49.79 37.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.598 0.713 . . . . 0.0 110.456 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 39.3 t80 62.15 39.38 12.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.832 0.825 . . . . 0.0 111.118 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -152.77 -68.3 0.16 Allowed 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.83 -0.544 . . . . 0.0 110.94 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.07 -36.95 77.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.096 -0.377 . . . . 0.0 111.213 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -51.81 -34.35 39.71 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.84 -50.1 67.99 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 121.685 -0.634 . . . . 0.0 110.32 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.4 t90 -65.69 -44.01 87.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.79 0.805 . . . . 0.0 109.695 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -35.72 81.33 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -96.13 -43.72 7.62 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -68.21 -6.66 24.72 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.693 -0.629 . . . . 0.0 112.552 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.764 HD12 ' N ' ' A' ' 683' ' ' ARG . 1.7 pp -60.63 -36.43 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 121.626 -0.671 . . . . 0.0 110.403 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.764 ' N ' HD12 ' A' ' 682' ' ' ILE . 9.9 ttt-85 -57.06 -47.27 81.38 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.046 0.45 . . . . 0.0 110.606 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -67.74 -34.13 65.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.4 OUTLIER -59.9 -31.33 69.72 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.041 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.872 HG21 HD12 ' B' ' 686' ' ' ILE . 14.5 mm -60.7 -49.31 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.117 0.484 . . . . 0.0 109.824 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.79 -40.39 84.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.99 -36.77 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.86 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 685' ' ' PHE . 86.9 t -54.16 -39.83 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.4 -37.09 91.5 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.4 m -64.87 -38.29 90.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.759 0.79 . . . . 0.0 109.602 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.751 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.1 -40.8 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.339 -179.292 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.81 -23.41 61.15 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.552 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -61.63 -38.28 87.09 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.03 0.919 . . . . 0.0 109.506 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.5 mmt180 -55.92 -28.0 54.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.286 1.034 . . . . 0.0 112.767 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 mm -58.7 -37.44 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 O-C-N 121.077 -1.014 . . . . 0.0 108.339 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.771 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.5 p -67.72 -30.74 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 121.481 -0.762 . . . . 0.0 109.887 176.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.5 m-85 -55.88 -28.68 57.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 110.442 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.04 71.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.8 m -64.49 -36.0 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.669 -0.644 . . . . 0.0 110.043 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.2 tp -57.7 -40.05 78.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 122.028 -0.42 . . . . 0.0 111.016 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 703' ' ' SER . . . . . 0.548 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 1.6 m -62.78 -37.41 86.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.534 0.683 . . . . 0.0 110.499 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -42.0 96.7 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 122.089 0.947 . . . . 0.0 108.702 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 748' ' ' LEU . 73.4 t -65.18 -43.74 95.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.981 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 706' ' ' ASN . . . . . 0.411 ' CG ' HE22 ' A' ' 710' ' ' GLN . 1.6 m-80 -62.22 -42.89 99.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.356 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.54 HH21 HG23 ' A' ' 708' ' ' VAL . 7.6 tmm_? -60.99 -43.79 98.36 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.411 0.624 . . . . 0.0 110.697 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.54 HG23 HH21 ' A' ' 707' ' ' ARG . 0.9 OUTLIER -74.4 -43.47 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.178 0.989 . . . . 0.0 109.179 178.795 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.13 -15.04 61.49 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 710' ' ' GLN . . . . . 0.411 HE22 ' CG ' ' A' ' 706' ' ' ASN . 0.2 OUTLIER -101.23 -22.3 14.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.62 1.554 . . . . 0.0 113.268 -177.552 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 711' ' ' GLY . . . . . 0.587 ' HA3' HD22 ' A' ' 715' ' ' LEU . . . 130.98 14.07 1.89 Allowed Glycine 0 CA--C 1.537 1.422 0 O-C-N 121.376 -0.828 . . . . 0.0 113.544 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.468 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 61.33 -127.62 0.83 Allowed 'General case' 0 CA--C 1.571 1.775 0 O-C-N 121.556 -0.967 . . . . 0.0 110.466 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.468 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 89.3 p -62.08 159.9 34.41 Favored Pre-proline 0 C--N 1.353 0.72 0 O-C-N 120.669 -1.27 . . . . 0.0 110.782 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -35.12 110.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.301 2.0 . . . . 0.0 112.593 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.639 HD23 ' OD2' ' C' ' 758' ' ' ASP . 0.0 OUTLIER -109.04 -20.73 12.92 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.834 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 122.56 1.172 . . . . 0.0 111.798 -179.622 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 121.683 0.754 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -58.02 -26.47 62.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.595 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -9.23 0.42 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 8.1 mtm-85 -62.89 -46.53 87.38 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.369 -0.832 . . . . 0.0 111.142 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.543 ' O ' HG23 ' C' ' 781' ' ' ILE . 44.4 p-10 -65.84 -38.68 89.51 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.283 0.563 . . . . 0.0 111.871 -178.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -71.44 -38.01 71.39 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 121.163 -0.96 . . . . 0.0 109.845 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 20.6 p -66.25 -45.96 78.77 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.948 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.83 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.4 mp -63.12 -46.74 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-O 117.89 -1.053 . . . . 0.0 111.262 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.446 ' HD2' ' HA ' ' C' ' 782' ' ' VAL 0.321 0.1 OUTLIER -69.93 -0.06 6.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 115.822 -2.351 . . . . 0.0 111.614 -177.624 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.795 ' O ' HD13 ' A' ' 748' ' ' LEU . 2.8 tm? -57.23 -15.65 6.41 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 169.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 746' ' ' ILE 0.314 2.0 t -53.4 -54.64 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 175.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -73.25 -27.21 61.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.48 173.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.478 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.8 -19.3 28.35 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.697 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 52.2 p -57.27 -37.23 72.07 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.91 -49.45 76.15 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.29 72.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.646 178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.15 -43.24 92.04 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.706 -0.621 . . . . 0.0 111.899 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 756' ' ' ILE . . . . . 0.424 HG22 HD12 ' A' ' 760' ' ' LEU . 49.2 mt -61.36 -33.66 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -69.43 -30.63 68.6 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.947 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 5.7 m-20 -56.07 -48.44 76.07 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.985 0.898 . . . . 0.0 108.955 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.39 -44.3 68.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.509 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.424 HD12 HG22 ' A' ' 756' ' ' ILE . 30.1 mt -67.37 -35.0 78.46 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -177.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 32.4 mtm180 -79.73 -19.51 48.63 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 68.6 p -77.36 -46.39 22.99 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.34 -0.85 . . . . 0.0 111.27 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 mp -68.89 -53.97 18.16 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 53.8 p -98.45 -48.95 4.83 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.221 -0.924 . . . . 0.0 111.939 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.8 tp 89.22 -82.97 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.675 1.19 . . . . 0.0 110.263 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -106.05 -65.42 1.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.572 -0.705 . . . . 0.0 110.756 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.6 m -103.05 144.44 31.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.117 0.484 . . . . 0.0 110.596 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -62.41 -26.74 68.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.085 0.469 . . . . 0.0 110.373 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -52.98 -39.06 62.73 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.599 0.714 . . . . 0.0 109.885 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.4 tpt85 -63.35 -30.62 71.72 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.662 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.42 -38.24 83.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.165 0.507 . . . . 0.0 110.481 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 58.0 ttp180 -59.03 -42.16 89.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.648 0.737 . . . . 0.0 109.207 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -69.05 -43.42 74.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.821 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -62.16 -37.7 86.19 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 121.53 0.681 . . . . 0.0 111.46 -179.317 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.39 -36.92 83.83 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 121.65 -0.656 . . . . 0.0 111.062 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.4 mt -74.15 -44.43 53.63 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 774' ' ' LEU . 2.3 pp -59.96 -37.14 71.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 121.98 -0.45 . . . . 0.0 111.419 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.753 ' O ' HG22 ' A' ' 781' ' ' ILE . 26.7 m -65.92 -43.17 93.0 Favored 'Isoleucine or valine' 0 C--N 1.346 0.42 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.757 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 782' ' ' VAL . 47.2 p -63.81 -46.6 84.39 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.433 -0.792 . . . . 0.0 111.508 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.11 -30.32 71.5 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.774 HG21 ' CG2' ' B' ' 746' ' ' ILE . 0.2 OUTLIER -53.35 -35.24 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 O-C-N 121.847 -0.533 . . . . 0.0 110.563 -178.01 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 779' ' ' THR . 17.1 m -53.76 -38.33 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -62.69 -43.22 99.37 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.761 0.791 . . . . 0.0 110.216 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 22.5 tp -68.03 -40.98 82.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.359 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 120.988 0.423 . . . . 0.0 111.826 -179.246 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 61.91 112.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.227 0.536 . . . . 0.0 109.865 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 170.99 -176.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.669 HD13 HD22 ' C' ' 660' ' ' LEU . 5.7 tp -54.33 -48.42 71.39 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 122.171 0.986 . . . . 0.0 109.663 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -65.4 -32.44 74.07 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.541 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -78.73 -44.18 24.07 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.151 0.5 . . . . 0.0 110.726 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.73 -44.08 62.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.299 0.571 . . . . 0.0 111.319 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.57 -30.28 71.2 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.999 0.428 . . . . 0.0 111.534 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 24.5 p -63.35 -25.79 68.46 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.068 0.461 . . . . 0.0 111.699 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.05 -38.67 86.99 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.304 0.574 . . . . 0.0 110.963 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -61.71 -12.98 19.05 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.978 0.418 . . . . 0.0 111.537 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.64 -32.28 20.65 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.241 0.543 . . . . 0.0 111.252 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.57 -52.19 64.4 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.48 0.657 . . . . 0.0 110.507 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 33.1 t80 58.19 27.76 15.56 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.409 0.623 . . . . 0.0 112.184 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -141.07 -71.17 0.36 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.436 0.636 . . . . 0.0 110.455 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.69 HD11 HD23 ' B' ' 679' ' ' LEU . 0.1 OUTLIER -68.18 -36.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.4 m -51.28 -33.49 28.86 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.039 -0.413 . . . . 0.0 111.539 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.94 -50.31 73.01 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.704 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.4 t90 -66.16 -41.86 89.77 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.933 0.873 . . . . 0.0 109.422 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.69 HD23 HD11 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -58.07 -35.52 71.49 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -177.723 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -109.46 -31.19 7.61 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -68.22 -6.76 25.34 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.451 -0.781 . . . . 0.0 112.91 -177.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.704 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.41 -36.29 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.6 -0.688 . . . . 0.0 110.839 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -53.32 -47.6 69.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.615 0.245 . . . . 0.0 111.028 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -71.54 -35.64 57.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.7 -31.07 69.25 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.064 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.872 HD12 HG21 ' A' ' 686' ' ' ILE . 15.0 mm -60.89 -47.28 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.774 -0.579 . . . . 0.0 109.918 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.71 -41.67 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.72 -37.94 73.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -60.18 -40.15 82.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 690' ' ' GLY . . . . . 0.545 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -61.41 -27.1 67.24 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 19.9 m -60.78 -45.38 94.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.607 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -33.13 71.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -176.479 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.859 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.1 OUTLIER -57.86 -43.93 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.932 0.787 . . . . 0.0 109.739 -178.7 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.05 -32.68 83.11 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.55 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.8 tt -60.46 -37.48 81.12 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 122.067 0.937 . . . . 0.0 110.769 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.751 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.9 mmt180 -55.87 -28.49 56.8 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.754 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.59 -36.39 59.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 O-C-N 120.978 -1.076 . . . . 0.0 110.419 -176.235 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -56.82 -30.22 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 121.253 -0.905 . . . . 0.0 110.561 178.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -56.53 -30.92 63.61 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.711 -0.618 . . . . 0.0 110.317 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.69 77.75 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -41.82 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.48 -37.74 73.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.077 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.7 m -62.86 -35.46 80.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 110.537 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.77 -43.21 97.07 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 122.406 1.098 . . . . 0.0 108.997 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.521 HG13 HD11 ' B' ' 748' ' ' LEU . 94.7 t -69.39 -45.49 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.201 1.001 . . . . 0.0 109.354 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.475 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 2.2 m120 -62.82 -35.58 80.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.199 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 16.1 ttm-85 -66.41 -50.25 64.06 Favored 'General case' 0 N--CA 1.44 -0.934 0 O-C-N 121.301 -0.874 . . . . 0.0 110.688 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.9 OUTLIER -78.72 -45.07 25.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -179.143 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -61.38 -45.23 95.24 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.4 pt20 -104.54 -22.89 13.2 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.66 167.64 11.03 Favored Glycine 0 CA--C 1.534 1.231 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.82 -83.6 0.55 Allowed 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.795 -0.827 . . . . 0.0 112.65 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.8 m -62.87 159.44 45.47 Favored Pre-proline 0 N--CA 1.463 0.184 0 O-C-N 121.331 -0.855 . . . . 0.0 110.177 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.582 ' HG3' HD23 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -30.08 108.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.529 2.153 . . . . 0.0 113.372 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.44 ' O ' ' C ' ' B' ' 716' ' ' SER . 4.8 tt -70.92 -20.38 62.49 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.44 ' C ' ' O ' ' B' ' 715' ' ' LEU . 12.4 t . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 122.402 1.096 . . . . 0.0 112.91 -178.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 11.9 mp0 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 mtp85 -72.24 -28.51 63.2 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.202 0.525 . . . . 0.0 110.975 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.9 -5.19 1.92 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.494 ' NE ' HD11 ' A' ' 774' ' ' LEU . 0.1 OUTLIER -54.87 -32.71 61.1 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.701 -1.249 . . . . 0.0 109.423 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -58.59 -34.61 71.29 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 122.08 0.943 . . . . 0.0 108.553 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 744' ' ' ARG . . . . . 0.48 ' HG2' HH21 ' B' ' 744' ' ' ARG . 0.0 OUTLIER -63.54 -46.96 83.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 122.141 0.972 . . . . 0.0 109.135 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 13.8 t -62.34 -47.18 85.37 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.783 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.774 ' CG2' HG21 ' A' ' 781' ' ' ILE . 1.4 mp -52.63 -21.4 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 O-C-N 121.24 -0.912 . . . . 0.0 109.655 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -43.54 98.64 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.669 -0.645 . . . . 0.0 110.542 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.521 HD11 HG13 ' B' ' 705' ' ' VAL . 0.9 OUTLIER -55.59 -15.37 2.84 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.668 -0.645 . . . . 0.0 111.964 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.44 -53.76 32.57 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -72.59 -17.77 61.66 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.125 174.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 751' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.0 -20.06 32.74 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.857 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 3.5 m -58.47 -38.45 77.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 118.356 1.078 . . . . 0.0 109.572 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.33 -48.04 58.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.65 0.738 . . . . 0.0 109.731 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.56 81.38 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -45.24 92.87 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.649 -0.657 . . . . 0.0 110.627 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 756' ' ' ILE . . . . . 0.439 HG22 HD12 ' B' ' 760' ' ' LEU . 47.2 mt -62.01 -36.4 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.11 -30.96 69.34 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.952 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.512 ' OD2' HD23 ' C' ' 715' ' ' LEU . 6.9 m-20 -55.94 -48.32 75.96 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.56 -45.32 65.67 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.034 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 760' ' ' LEU . . . . . 0.439 HD12 HG22 ' B' ' 756' ' ' ILE . 19.9 mt -66.91 -31.79 72.61 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -79.98 -49.47 11.79 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.2 m -65.24 -45.23 85.48 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.543 -0.723 . . . . 0.0 111.576 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.586 ' HG ' HD22 ' B' ' 774' ' ' LEU . 1.9 tp -64.66 -53.25 50.48 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.838 -0.539 . . . . 0.0 112.447 -178.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 764' ' ' SER . . . . . 0.411 ' OG ' HD12 ' B' ' 771' ' ' LEU . 3.0 m -97.5 -47.57 5.61 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 1.8 mt 71.63 107.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.8 0.81 . . . . 0.0 110.315 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.89 -78.45 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.881 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -110.11 175.47 5.42 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.612 0.72 . . . . 0.0 111.572 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -84.22 -27.96 27.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.064 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.61 -40.14 82.43 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 122.109 0.957 . . . . 0.0 109.149 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.62 -29.26 67.88 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.892 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.411 HD12 ' OG ' ' B' ' 764' ' ' SER . 8.4 tt -59.16 -32.33 69.79 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.679 -0.638 . . . . 0.0 109.986 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -56.78 -32.51 65.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.03 -41.26 99.47 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.586 HD22 ' HG ' ' B' ' 763' ' ' LEU . 2.7 tp -58.86 -38.49 78.9 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-O 121.388 0.613 . . . . 0.0 110.835 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.34 -37.04 74.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.275 0.56 . . . . 0.0 109.997 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.42 -34.85 68.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.056 0.455 . . . . 0.0 110.592 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.3 -39.26 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.089 0.471 . . . . 0.0 109.779 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.76 ' O ' HG22 ' B' ' 781' ' ' ILE . 58.6 t -66.28 -46.63 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.784 -0.572 . . . . 0.0 109.945 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.645 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -64.21 -44.48 91.82 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 122.079 -0.388 . . . . 0.0 112.023 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -31.5 72.04 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 122.052 -0.405 . . . . 0.0 111.739 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.76 HG22 ' O ' ' B' ' 778' ' ' VAL . 0.4 OUTLIER -60.01 -36.6 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 O-C-N 121.727 -0.608 . . . . 0.0 112.07 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.645 HG22 ' O ' ' B' ' 779' ' ' THR . 5.4 m -59.22 -41.78 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 121.655 -0.653 . . . . 0.0 112.083 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -41.85 91.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.273 0.559 . . . . 0.0 111.338 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.68 -44.04 67.84 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.659 HD23 ' CG ' ' C' ' 750' ' ' ASN . 18.9 tp -83.78 -22.87 31.72 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.027 0.441 . . . . 0.0 111.73 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.67 -33.21 62.49 Favored Glycine 0 CA--C 1.533 1.217 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -83.19 146.99 28.3 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.398 0.618 . . . . 0.0 110.581 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.476 179.691 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.669 HD22 HD13 ' B' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 CA-C-O 120.641 0.258 . . . . 0.0 110.784 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 25.7 mt 59.62 110.74 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.519 0.676 . . . . 0.0 110.852 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.6 171.1 10.55 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 121.244 0.545 . . . . 0.0 109.711 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.6 OUTLIER -56.91 -50.48 72.41 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.62 0.724 . . . . 0.0 110.054 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.541 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -75.18 -16.86 60.48 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.908 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -80.96 -49.01 11.5 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.022 0.439 . . . . 0.0 110.881 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -62.71 -46.14 89.52 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.248 0.547 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.23 -23.54 67.47 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -30.55 68.24 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 122.003 -0.436 . . . . 0.0 111.781 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -39.67 94.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -59.47 -13.51 9.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.762 -0.586 . . . . 0.0 111.848 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -81.77 -21.11 37.99 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.277 0.561 . . . . 0.0 110.899 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -62.44 -42.22 99.3 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.648 0.737 . . . . 0.0 110.138 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 61.37 24.76 14.82 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -154.09 -72.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.562 -0.711 . . . . 0.0 112.313 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -37.1 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-O 121.52 0.676 . . . . 0.0 110.257 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.8 m -52.2 -33.7 42.16 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.778 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -56.52 -48.88 76.31 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 121.63 0.729 . . . . 0.0 109.341 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.524 ' O ' HG23 ' C' ' 682' ' ' ILE . 3.8 t90 -58.86 -38.09 77.97 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.874 -0.516 . . . . 0.0 109.8 178.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 9.4 mt -60.72 -41.08 94.6 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -103.27 -39.22 6.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -68.87 -18.56 64.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.759 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.45 -36.57 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.449 -0.782 . . . . 0.0 109.947 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.759 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -53.7 -46.98 70.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.02 -35.23 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.97 -36.77 77.83 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.994 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.811 HG21 HD12 ' A' ' 686' ' ' ILE . 18.5 mm -60.78 -45.53 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.89 -38.43 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.91 -37.99 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.5 -40.01 72.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.29 -37.54 73.87 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.0 m -67.37 -38.64 85.08 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.452 1.12 . . . . 0.0 109.661 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.415 HD23 HG12 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.6 -46.12 89.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.406 -177.595 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.415 HD12 ' N ' ' C' ' 694' ' ' GLY . 1.7 pp -60.29 -43.63 93.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 O-C-N 122.017 -0.427 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.54 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.74 -30.68 73.17 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.61 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -53.77 -37.22 63.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.058 0.932 . . . . 0.0 110.139 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.859 ' HE ' HD11 ' B' ' 693' ' ' ILE . 23.0 mmt180 -55.69 -27.85 52.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.54 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -57.66 -35.41 50.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.079 -1.013 . . . . 0.0 110.831 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.61 HG12 ' O ' ' C' ' 695' ' ' LEU . 14.5 p -54.08 -29.86 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.223 -0.923 . . . . 0.0 109.527 177.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -56.83 -31.69 65.0 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.263 -0.898 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 700' ' ' ALA . . . . . 0.548 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.14 -45.3 93.51 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 45.3 t -65.82 -35.86 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.009 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -64.95 -44.89 87.95 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.231 0.539 . . . . 0.0 110.865 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 36.3 p -64.13 -33.04 74.88 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.15 0.5 . . . . 0.0 110.776 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.75 95.23 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.833 0.825 . . . . 0.0 108.922 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' C' ' 748' ' ' LEU . 0.9 OUTLIER -67.62 -45.81 84.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-O 122.149 0.976 . . . . 0.0 108.618 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.06 -36.48 83.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.224 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -49.21 73.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.208 0.528 . . . . 0.0 111.26 -177.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.556 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -76.73 -42.98 34.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.501 0.667 . . . . 0.0 111.511 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -70.38 -41.35 73.18 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 710' ' ' GLN . . . . . 0.407 ' O ' HD22 ' C' ' 715' ' ' LEU . 3.0 mt-30 -102.23 -22.13 14.23 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.759 0.79 . . . . 0.0 112.973 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.35 160.37 24.21 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -112.98 -47.63 3.03 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.936 -0.743 . . . . 0.0 111.536 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.452 ' HA ' HG21 ' B' ' 708' ' ' VAL . 79.5 p -69.11 144.28 95.14 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 118.616 -0.707 . . . . 0.0 110.306 -179.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -35.23 97.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.553 0 C-N-CA 122.261 1.974 . . . . 0.0 112.394 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.512 HD23 ' OD2' ' B' ' 758' ' ' ASP . 13.6 tp -75.19 5.1 5.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.82 0.819 . . . . 0.0 112.277 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 122.422 1.106 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -61.1 -26.55 67.74 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.61 -1.177 . . . . 0.0 112.084 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.7 -11.59 1.0 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -68.42 -40.89 81.03 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.53 -0.731 . . . . 0.0 111.46 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.33 -36.02 72.78 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 122.031 -0.418 . . . . 0.0 110.501 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -71.34 -46.73 59.84 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.337 0.589 . . . . 0.0 110.017 178.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 3.1 p -59.93 -38.51 82.62 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.469 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.548 ' CG2' HG21 ' B' ' 781' ' ' ILE . 1.0 OUTLIER -57.44 -19.67 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.678 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -59.55 -28.11 66.81 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.556 HD11 HG12 ' C' ' 708' ' ' VAL . 15.7 mt -55.65 -20.39 13.8 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.915 178.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 749' ' ' VAL . . . . . 0.496 HG23 ' O ' ' C' ' 746' ' ' ILE . 70.7 t -56.0 -54.89 21.82 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.659 ' CG ' HD23 ' B' ' 785' ' ' LEU . 7.3 m120 -73.29 -21.9 60.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.784 174.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.15 33.32 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.206 -178.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 37.5 m -58.59 -37.73 76.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 117.921 0.861 . . . . 0.0 109.315 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -69.45 -50.44 45.55 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.496 0.665 . . . . 0.0 109.743 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.2 -35.36 80.06 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.521 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.7 tm? -59.82 -45.34 92.67 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 111.158 -178.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 64.4 mt -67.77 -41.77 85.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.86 0.838 . . . . 0.0 109.338 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.14 -30.09 68.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.207 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 758' ' ' ASP . . . . . 0.639 ' OD2' HD23 ' A' ' 715' ' ' LEU . 81.4 m-20 -55.32 -48.87 73.5 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.495 -0.753 . . . . 0.0 109.987 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -70.58 -44.72 66.76 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.876 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 62.3 mt -68.88 -36.08 77.66 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 26.2 mtm180 -72.39 -50.02 29.63 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.965 -0.459 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.5 t -64.87 -44.45 89.65 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 122.159 0.981 . . . . 0.0 110.337 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.1 tt -67.94 -53.17 28.36 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.212 -0.903 . . . . 0.0 113.225 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.437 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.3 m -96.78 -37.47 10.26 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 56.5 mt 62.06 116.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.466 0.651 . . . . 0.0 110.128 -178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 2.0 t80 59.29 -162.96 0.23 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.874 -0.516 . . . . 0.0 109.997 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 p -83.38 91.89 7.43 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.667 0.746 . . . . 0.0 111.671 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 42.42 -165.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.888 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 10.9 t60 75.91 -61.42 0.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -61.31 -30.06 70.26 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.702 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.437 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.0 tt -60.04 -30.8 69.43 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 122.075 -0.391 . . . . 0.0 109.957 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -56.69 -35.15 68.15 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 773' ' ' ASP . . . . . 0.401 ' O ' HG13 ' C' ' 777' ' ' ILE . 3.7 m-20 -67.12 -37.06 83.23 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.684 HD13 ' O ' ' C' ' 774' ' ' LEU . 1.8 tm? -58.06 -38.49 76.41 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.064 0.459 . . . . 0.0 110.21 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.467 ' O ' HG22 ' C' ' 778' ' ' VAL . 9.8 mp -58.98 -37.59 77.16 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 51.1 mt -75.09 -39.99 60.33 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 121.675 -0.641 . . . . 0.0 111.339 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.474 HG22 HG13 ' C' ' 781' ' ' ILE . 29.1 mt -62.49 -37.49 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.563 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.467 HG22 ' O ' ' C' ' 775' ' ' LEU . 7.8 m -55.16 -39.83 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.202 0.91 . . . . 0.0 110.015 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.445 ' O ' HG22 ' C' ' 782' ' ' VAL . 5.8 m -63.41 -39.8 95.47 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 121.871 0.843 . . . . 0.0 109.741 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.43 -37.55 83.2 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.536 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.83 HG21 ' HB ' ' A' ' 746' ' ' ILE . 89.4 mt -61.69 -47.69 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.41 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.446 ' HA ' ' HD2' ' A' ' 747' ' ' ARG . 20.7 m -54.13 -37.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 119.23 -0.988 . . . . 0.0 110.677 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 CA--C 1.543 0.696 0 CA-C-O 121.318 0.58 . . . . 0.0 111.694 179.199 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 121.669 0.747 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mt 61.92 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.996 0.903 . . . . 0.0 111.82 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 174.81 163.59 0.23 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.495 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.416 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.8 OUTLIER -46.36 -41.48 13.52 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.64 0.733 . . . . 0.0 110.148 178.859 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -33.87 76.97 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.774 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -74.8 -44.77 47.7 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.417 0.627 . . . . 0.0 109.782 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -63.12 -46.39 87.53 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.436 0.636 . . . . 0.0 110.364 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.19 61.82 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.493 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 2.7 m -65.38 -33.25 75.52 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.604 HD23 HG23 ' A' ' 676' ' ' THR . 19.6 tp -65.35 -23.75 67.07 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.808 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -60.02 -29.47 68.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.933 -0.48 . . . . 0.0 111.586 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.8 -14.48 62.78 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 19.4 m95 -68.44 -49.63 58.5 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.439 0.638 . . . . 0.0 110.108 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 13.3 t80 65.83 2.77 2.28 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -126.04 -66.78 0.91 Allowed 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.279 -0.888 . . . . 0.0 111.942 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.42 -36.92 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 121.368 0.604 . . . . 0.0 111.025 -179.049 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.604 HG23 HD23 ' A' ' 669' ' ' LEU . 2.9 m -52.07 -33.38 38.96 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.471 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -56.4 -49.57 74.1 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.507 0.67 . . . . 0.0 109.777 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.77 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.8 t90 -65.36 -43.9 89.34 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 121.084 0.469 . . . . 0.0 109.809 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.485 HD12 HD21 ' A' ' 669' ' ' LEU . 2.6 mt -61.92 -34.85 76.83 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.9 t90 -103.52 -15.03 15.97 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -94.5 -9.19 36.15 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.77 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -62.38 -35.95 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 O-C-N 121.371 -0.831 . . . . 0.0 110.818 179.054 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -47.42 68.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.783 0.325 . . . . 0.0 111.266 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -70.9 -35.34 59.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.496 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -60.61 -29.0 68.94 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.584 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.868 HD12 HG21 ' C' ' 686' ' ' ILE . 15.9 mm -60.52 -51.06 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.739 -0.601 . . . . 0.0 110.123 -179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.62 -41.03 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.93 -37.49 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.31 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 685' ' ' PHE . 61.6 t -54.86 -43.29 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -52.68 -40.08 55.44 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.9 m -65.49 -38.67 90.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.848 0.832 . . . . 0.0 109.615 177.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.73 -43.05 94.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.304 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.512 HD11 HH11 ' B' ' 696' ' ' ARG . 0.8 OUTLIER -65.36 -42.7 94.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-O 121.126 0.489 . . . . 0.0 109.951 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.85 -24.92 65.17 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 178.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -55.92 -38.61 70.51 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.021 0.915 . . . . 0.0 109.185 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.0 mmt180 -55.72 -28.15 54.26 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.827 0.851 . . . . 0.0 111.775 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.99 -39.09 77.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.801 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.74 -30.76 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.662 -0.649 . . . . 0.0 109.963 176.313 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.9 m-85 -55.76 -29.34 59.45 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 122.003 -0.436 . . . . 0.0 110.692 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.56 -37.24 72.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -60.71 -35.98 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 O-C-N 121.701 -0.624 . . . . 0.0 109.503 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.92 -44.62 91.35 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.81 -0.556 . . . . 0.0 109.88 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -34.66 77.78 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 122.117 0.96 . . . . 0.0 108.819 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.573 HD13 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -60.63 -44.29 96.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 122.308 1.052 . . . . 0.0 108.272 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.669 HG22 HD12 ' A' ' 748' ' ' LEU . 54.2 t -66.81 -41.81 88.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.889 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -62.34 -36.91 83.68 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.036 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.573 HH22 HD13 ' A' ' 704' ' ' LEU . 36.0 ttm105 -57.65 -49.49 76.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 120.833 -1.167 . . . . 0.0 110.481 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.412 HG21 ' HD2' ' B' ' 714' ' ' PRO . 1.0 OUTLIER -76.97 -45.21 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.147 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -74.71 -18.33 60.53 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -101.26 -21.01 15.01 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 120.15 13.64 5.83 Favored Glycine 0 CA--C 1.542 1.78 0 O-C-N 121.604 -0.685 . . . . 0.0 113.115 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 59.29 -83.77 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 O-C-N 121.934 -0.745 . . . . 0.0 112.069 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 92.2 p -102.77 159.99 27.62 Favored Pre-proline 0 C--N 1.347 0.462 0 O-C-N 121.2 -0.938 . . . . 0.0 109.721 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -41.75 106.57 0.07 OUTLIER 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.386 1.391 . . . . 0.0 111.104 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.555 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -104.82 -20.64 13.53 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -175.733 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.555 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.1 t . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 121.498 0.666 . . . . 0.0 111.723 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 . . . . . 0 C--O 1.237 0.395 0 CA-C-O 121.714 0.768 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -57.91 -26.29 62.0 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.305 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -15.65 2.87 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.915 -0.49 . . . . 0.0 111.394 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.595 ' CZ ' HD21 ' C' ' 774' ' ' LEU . 21.0 ttp180 -62.61 -46.12 89.73 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.858 -0.526 . . . . 0.0 109.898 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -59.15 -33.89 71.44 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.849 0.833 . . . . 0.0 109.043 178.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.54 66.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.721 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 8.4 p -58.44 -44.46 89.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.835 -0.541 . . . . 0.0 110.204 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.792 ' O ' HG22 ' A' ' 749' ' ' VAL . 1.9 mp -56.52 -20.9 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.245 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 -59.14 -24.29 62.9 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.468 -0.77 . . . . 0.0 110.178 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.786 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -70.59 -17.87 62.9 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.984 -0.448 . . . . 0.0 111.576 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.792 HG22 ' O ' ' A' ' 746' ' ' ILE . 29.9 m -55.76 -54.91 21.06 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 O-C-N 120.793 -1.192 . . . . 0.0 110.78 -178.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.506 ' OD1' HG23 ' A' ' 749' ' ' VAL . 5.5 m120 -72.75 -21.42 61.02 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 173.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.68 30.82 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.699 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 3.3 p -57.92 -37.79 74.73 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.808 0.804 . . . . 0.0 109.261 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.9 tp -65.38 -49.48 69.15 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.98 -34.58 76.41 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.703 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.415 ' C ' HD23 ' A' ' 755' ' ' LEU . 7.0 tt -58.77 -44.85 90.74 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 122.013 -0.43 . . . . 0.0 111.477 -177.081 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 6.7 mm -63.04 -33.33 60.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.29 -30.02 68.01 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.494 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 30.5 m-20 -54.97 -47.13 74.97 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.672 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.58 -45.2 65.83 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.733 0.778 . . . . 0.0 111.043 178.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.458 ' HA ' HD11 ' A' ' 763' ' ' LEU . 24.2 mt -62.54 -29.58 70.67 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 44.7 mtt85 -81.07 -23.28 38.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 9.9 t -75.75 -46.83 28.71 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.88 -1.137 . . . . 0.0 111.955 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.531 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.0 OUTLIER -69.66 -54.37 14.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 764' ' ' SER . . . . . 0.4 ' O ' ' HB3' ' A' ' 765' ' ' LEU . 18.4 p -98.09 -36.97 9.92 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -176.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.555 HD22 ' O ' ' A' ' 765' ' ' LEU . 0.6 OUTLIER 73.35 -61.62 0.49 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.142 0.577 . . . . 0.0 110.745 -177.607 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 766' ' ' PHE . . . . . 0.536 ' HB2' HD13 ' A' ' 765' ' ' LEU . 40.7 t80 -139.13 -68.74 0.43 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.602 -0.686 . . . . 0.0 111.048 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.9 m -79.78 126.3 30.79 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.982 -0.449 . . . . 0.0 110.02 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.514 ' CE1' HD13 ' A' ' 771' ' ' LEU . 2.7 t80 -57.3 -20.42 28.16 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.967 0.413 . . . . 0.0 110.926 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.1 -40.19 95.02 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.982 0.896 . . . . 0.0 108.745 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -55.86 -29.22 59.54 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.268 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.514 HD13 ' CE1' ' A' ' 768' ' ' TYR . 8.6 tt -59.3 -38.47 80.31 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.957 -0.464 . . . . 0.0 111.608 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -64.63 -32.83 74.67 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.333 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.75 -42.42 99.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.091 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 763' ' ' LEU . 4.0 tp -58.45 -42.19 86.83 Favored 'General case' 0 C--N 1.354 0.776 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.346 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.4 tp -59.06 -36.86 75.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.017 0.437 . . . . 0.0 112.163 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 26.5 mt -74.57 -44.39 51.12 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.953 -0.467 . . . . 0.0 111.529 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 34.3 pt -68.4 -37.19 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 O-C-N 122.119 -0.363 . . . . 0.0 111.312 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.74 -46.6 96.19 Favored 'Isoleucine or valine' 0 C--N 1.345 0.387 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.166 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 782' ' ' VAL . 36.7 p -64.66 -36.71 85.14 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.872 0.844 . . . . 0.0 110.813 177.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -43.87 77.24 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.71 HD11 ' CG2' ' B' ' 746' ' ' ILE . 35.3 pt -69.97 -36.73 70.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 779' ' ' THR . 21.3 m -55.76 -38.05 49.54 Favored 'Isoleucine or valine' 0 C--N 1.359 1.019 0 CA-C-N 119.427 1.012 . . . . 0.0 109.117 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.08 -50.36 69.35 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 121.826 0.822 . . . . 0.0 110.112 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.5 -41.03 98.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 CA--C 1.538 0.503 0 CA-C-O 121.339 0.59 . . . . 0.0 111.188 179.996 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.666 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.666 HD22 ' C ' ' B' ' 660' ' ' LEU . 0.4 OUTLIER 60.2 124.12 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.173 0.511 . . . . 0.0 110.598 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 662' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' B' ' 663' ' ' LEU . 0.4 OUTLIER -174.64 29.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.604 -0.685 . . . . 0.0 112.025 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.592 HD12 HD13 ' C' ' 660' ' ' LEU . 0.3 OUTLIER 75.06 -42.74 0.49 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.799 0.809 . . . . 0.0 109.657 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.539 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.7 t70 -79.98 -31.87 39.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.762 0.792 . . . . 0.0 109.874 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.53 -41.54 79.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.507 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.592 ' CE2' HD12 ' B' ' 661' ' ' LEU . 89.1 m95 -75.02 -46.51 34.54 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.338 0.589 . . . . 0.0 111.534 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.29 71.19 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.87 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 88.3 p -62.76 -33.48 75.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.977 0.417 . . . . 0.0 111.474 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.82 -32.02 70.26 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.297 0.57 . . . . 0.0 111.081 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -62.55 -23.26 66.89 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.899 0.381 . . . . 0.0 111.918 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -81.79 -13.06 58.22 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.897 0.38 . . . . 0.0 111.813 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -69.98 -46.69 64.66 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.48 0.657 . . . . 0.0 110.903 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 47.8 t80 57.26 34.39 24.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.73 0.776 . . . . 0.0 110.939 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -140.7 -87.53 0.18 Allowed 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.781 -0.574 . . . . 0.0 111.139 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.408 HG12 ' CE3' ' B' ' 678' ' ' TRP . 18.5 tt -68.2 -35.98 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 O-C-N 121.57 -0.706 . . . . 0.0 112.178 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.2 m -50.38 -32.5 17.68 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.714 -0.616 . . . . 0.0 111.545 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -55.96 -44.86 78.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.625 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -60.61 -43.7 97.14 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.838 0.828 . . . . 0.0 108.905 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.1 tp -57.86 -40.11 79.38 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.815 -178.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -100.85 -3.05 30.55 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -101.47 -23.14 14.38 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.589 -0.694 . . . . 0.0 112.164 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.625 HG23 ' O ' ' B' ' 678' ' ' TRP . 28.8 pt -60.44 -35.83 65.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 O-C-N 121.875 -0.516 . . . . 0.0 110.494 178.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 22.3 ttt-85 -53.31 -47.2 69.46 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.792 -0.568 . . . . 0.0 110.098 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.485 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.1 mp -75.21 -36.3 36.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.66 -27.66 66.58 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.874 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.47 -45.36 97.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.32 -43.57 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 97.0 mt -58.64 -37.74 67.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' B' ' 685' ' ' PHE . 45.5 t -61.69 -47.46 93.24 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.936 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.15 -27.06 13.8 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.774 -0.579 . . . . 0.0 112.205 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 37.0 m -60.63 -44.16 96.68 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.574 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.46 -32.39 70.19 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.154 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.574 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.5 OUTLIER -57.71 -44.58 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.301 -0.875 . . . . 0.0 108.694 -178.731 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.46 -31.55 77.88 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 178.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.615 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.18 -37.82 67.55 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 122.065 0.936 . . . . 0.0 109.467 178.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.512 HH11 HD11 ' A' ' 693' ' ' ILE . 24.0 mmt180 -55.65 -28.55 56.04 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.638 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.02 -35.95 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 121.022 -1.048 . . . . 0.0 108.943 -178.987 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.615 HG12 ' O ' ' B' ' 695' ' ' LEU . 1.2 p -66.04 -30.2 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 O-C-N 121.901 -0.5 . . . . 0.0 110.269 177.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 3.4 m-85 -56.12 -30.71 62.49 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.828 -0.545 . . . . 0.0 109.532 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.81 77.29 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 177.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.38 -38.14 76.74 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.451 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 9.2 tp -58.72 -43.67 90.2 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.069 -0.395 . . . . 0.0 110.281 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 80.3 p -63.82 -31.72 73.0 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.778 0.799 . . . . 0.0 109.839 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -47.29 83.99 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 122.531 1.157 . . . . 0.0 109.142 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.465 ' HA ' HD13 ' B' ' 748' ' ' LEU . 56.1 t -70.19 -45.18 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.631 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.82 -36.04 81.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.143 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.442 HH21 ' HG3' ' B' ' 707' ' ' ARG . 4.6 ttm-85 -63.11 -49.28 75.04 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.524 1.154 . . . . 0.0 109.772 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.453 HG21 ' HD3' ' C' ' 714' ' ' PRO . 2.2 t -77.28 -44.82 30.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 114.27 -1.332 . . . . 0.0 114.183 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -70.22 -45.02 67.39 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -175.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.9 pt20 -104.97 -22.96 13.04 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 127.94 177.43 14.86 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 712' ' ' TYR . . . . . 0.48 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.0 p90 -129.97 -69.45 0.67 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 21.8 m -62.24 159.36 40.03 Favored Pre-proline 0 N--CA 1.467 0.391 0 O-C-N 121.312 -0.867 . . . . 0.0 109.24 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.412 ' HD2' HG21 ' A' ' 708' ' ' VAL . 37.8 Cg_exo -34.26 102.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.16 1.907 . . . . 0.0 111.884 -178.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.458 ' O ' ' C ' ' B' ' 716' ' ' SER . 0.5 OUTLIER -76.28 -20.0 57.75 Favored 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -175.393 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.458 ' C ' ' O ' ' B' ' 715' ' ' LEU . 77.6 p . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.524 0.678 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.16 -26.51 62.11 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -178.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -13.13 57.68 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.07 71.21 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 121.034 -1.041 . . . . 0.0 112.124 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.44 -45.27 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.28 -37.07 71.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.178 0.513 . . . . 0.0 110.208 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 745' ' ' SER . . . . . 0.407 ' HB3' HG12 ' B' ' 708' ' ' VAL . 52.8 m -57.13 -34.09 68.04 Favored 'General case' 0 C--O 1.231 0.084 0 CA-C-O 120.992 0.425 . . . . 0.0 110.49 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.71 ' CG2' HD11 ' A' ' 781' ' ' ILE . 23.1 mt -57.68 -16.08 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.66 -33.51 71.64 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 177.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' B' ' 705' ' ' VAL . 0.4 OUTLIER -55.73 -16.16 3.97 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.668 178.643 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 39.6 t -55.77 -53.69 34.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 177.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -72.1 -19.93 61.72 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.084 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.87 31.53 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.834 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.22 -37.64 75.23 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.956 -0.732 . . . . 0.0 109.379 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.0 -48.58 57.58 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 108.945 177.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.71 -34.84 73.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.805 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.03 -42.93 91.4 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.992 0.425 . . . . 0.0 111.233 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 46.6 mm -67.77 -35.62 73.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.51 -33.53 74.3 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.449 ' OD2' HD23 ' C' ' 715' ' ' LEU . 10.0 m-20 -55.92 -47.99 76.49 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.208 -0.933 . . . . 0.0 108.889 179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.45 -45.13 66.41 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.088 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -46.07 90.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -81.87 -25.4 35.09 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.9 p -71.23 -46.45 61.07 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.944 -1.098 . . . . 0.0 111.648 -177.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.684 ' O ' HD22 ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.45 -54.59 13.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -179.732 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.85 -33.94 10.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 68.52 88.42 0.11 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.743 0.782 . . . . 0.0 109.95 -176.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 58.98 -86.16 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.036 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -79.85 162.23 25.17 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 121.405 -0.809 . . . . 0.0 110.684 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -92.62 25.29 3.13 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.218 0.533 . . . . 0.0 111.479 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -90.98 -41.89 10.85 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.833 0.825 . . . . 0.0 109.149 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -29.46 70.34 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.32 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.37 -34.12 72.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -60.84 -43.18 98.63 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -69.56 -38.4 77.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.714 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.3 OUTLIER -67.34 -38.03 84.22 Favored 'General case' 0 C--N 1.344 0.341 0 O-C-N 121.659 -0.65 . . . . 0.0 111.308 -179.655 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 20.0 mt -58.67 -37.17 75.43 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.577 -0.702 . . . . 0.0 111.665 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 776' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 779' ' ' THR . 1.2 pp -74.11 -34.29 63.88 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.73 -0.607 . . . . 0.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 777' ' ' ILE . . . . . 0.622 HD11 ' HG ' ' B' ' 774' ' ' LEU . 10.2 pt -70.39 -36.27 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.076 -1.015 . . . . 0.0 110.005 177.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 774' ' ' LEU . 57.9 t -55.11 -46.29 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.678 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.1 t -63.95 -35.64 81.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.484 -0.76 . . . . 0.0 109.581 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 9.7 tpt85 -61.27 -31.88 71.7 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.974 -0.454 . . . . 0.0 110.886 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.687 HG21 HG22 ' C' ' 746' ' ' ILE . 7.1 mm -61.19 -48.04 90.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 O-C-N 122.047 -0.408 . . . . 0.0 110.642 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.678 HG22 ' O ' ' B' ' 779' ' ' THR . 6.2 m -55.31 -38.22 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.504 -0.748 . . . . 0.0 111.11 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.61 -52.24 66.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.404 0.621 . . . . 0.0 110.76 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.1 -44.03 66.47 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.605 0.717 . . . . 0.0 111.966 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.466 HD22 ' OD1' ' C' ' 750' ' ' ASN . 0.1 OUTLIER -73.16 -14.56 61.39 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.682 -178.668 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -54.45 -40.88 70.77 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 11.5 ptp85 -100.93 130.55 46.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.334 0.587 . . . . 0.0 109.995 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.172 -0.918 . . . . 0.0 110.88 -179.228 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.592 HD13 HD12 ' B' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.125 0.488 . . . . 0.0 110.118 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.495 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.3 mp 60.45 123.02 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.723 0.773 . . . . 0.0 111.392 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 178.8 171.29 0.83 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.85 -49.35 76.98 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.174 0.988 . . . . 0.0 109.238 178.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -67.12 -23.07 65.78 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.561 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -48.73 12.06 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.361 0.601 . . . . 0.0 110.071 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -63.44 -45.21 91.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.553 0.692 . . . . 0.0 110.315 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.75 -18.01 65.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.98 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.37 -33.52 67.3 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.923 -0.486 . . . . 0.0 111.778 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.464 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -60.15 -33.95 72.87 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -62.03 -17.58 57.78 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 121.645 -0.659 . . . . 0.0 111.801 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -86.05 -25.21 26.03 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.244 0.545 . . . . 0.0 111.133 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.409 ' CE3' HG21 ' C' ' 675' ' ' ILE . 12.5 m95 -62.84 -40.71 98.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.526 0.679 . . . . 0.0 110.237 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 58.35 34.67 24.23 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.093 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -161.03 -69.08 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.531 -0.731 . . . . 0.0 112.274 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.716 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -59.07 -37.81 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 111.168 -178.832 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.72 -33.91 50.13 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.977 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 677' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' C' ' 681' ' ' TYR . 10.2 m120 -65.69 -50.41 65.0 Favored 'General case' 0 C--O 1.223 -0.332 0 O-C-N 121.927 -0.483 . . . . 0.0 110.722 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.465 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -65.47 -44.24 87.8 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.489 0.661 . . . . 0.0 109.797 178.764 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.628 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.14 -35.63 81.41 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.884 -178.708 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -101.53 -9.77 20.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 681' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' C' ' 677' ' ' ASN . 3.1 m-85 -92.09 -21.37 20.49 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.475 -0.765 . . . . 0.0 111.201 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.545 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.2 pt -60.71 -37.05 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.822 0.344 . . . . 0.0 110.16 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 -56.9 -47.3 80.84 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.481 0.658 . . . . 0.0 109.798 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.17 -34.16 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -60.68 -29.91 69.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.469 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.868 HG21 HD12 ' A' ' 686' ' ' ILE . 10.0 mm -60.84 -47.89 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.429 0.633 . . . . 0.0 109.415 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -61.62 -40.38 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.82 -37.68 67.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.536 HG23 ' O ' ' C' ' 685' ' ' PHE . 85.0 t -55.61 -41.12 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.55 -40.35 77.92 Favored Glycine 0 C--N 1.345 1.067 0 N-CA-C 108.813 -1.715 . . . . 0.0 108.813 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.1 -40.23 86.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.052 0.93 . . . . 0.0 109.373 177.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.403 HD23 HG12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -60.56 -46.68 89.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.576 -178.121 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.8 pp -68.53 -41.91 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 121.25 0.548 . . . . 0.0 110.375 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.609 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.28 -32.32 76.44 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 178.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.655 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.8 tt -60.08 -37.46 79.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.062 0.934 . . . . 0.0 110.158 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -55.98 -28.57 57.69 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.609 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.56 -35.42 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.254 -0.904 . . . . 0.0 110.644 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.668 ' O ' HG22 ' C' ' 701' ' ' VAL . 7.5 p -53.97 -29.23 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.728 -0.607 . . . . 0.0 110.621 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -54.9 -29.3 55.55 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.732 -0.605 . . . . 0.0 110.533 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.07 -37.63 74.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.668 HG22 ' O ' ' C' ' 698' ' ' VAL . 3.2 m -68.87 -35.77 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-O 121.645 0.736 . . . . 0.0 109.372 177.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.12 -37.88 84.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.035 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 22.0 m -62.97 -36.35 83.2 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.248 0.547 . . . . 0.0 110.408 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.1 -40.67 94.88 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.304 1.05 . . . . 0.0 108.841 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.434 HG22 HD23 ' C' ' 748' ' ' LEU . 87.3 t -65.36 -45.1 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 706' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 3.2 m120 -63.05 -36.91 85.15 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.021 0.915 . . . . 0.0 110.793 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.417 ' HD3' ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -60.04 -51.21 70.61 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.353 1.073 . . . . 0.0 110.596 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -78.3 -45.96 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.555 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.52 -40.24 61.88 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 710' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' C' ' 706' ' ' ASN . 0.0 OUTLIER -101.79 -21.44 14.6 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-O 121.665 0.745 . . . . 0.0 112.347 -176.572 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.46 -170.46 18.4 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -134.51 -53.36 0.83 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.863 -0.786 . . . . 0.0 112.059 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.446 ' HA ' HG21 ' B' ' 708' ' ' VAL . 0.9 OUTLIER -73.55 145.76 85.26 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.178 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 714' ' ' PRO . . . . . 0.453 ' HD3' HG21 ' B' ' 708' ' ' VAL . 71.2 Cg_exo -36.07 110.25 0.07 OUTLIER 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.268 1.979 . . . . 0.0 112.397 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.507 ' N ' HD22 ' C' ' 715' ' ' LEU . 2.9 mm? -74.35 -20.03 60.24 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -177.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 716' ' ' SER . . . . . 0.468 ' C ' ' O ' ' C' ' 715' ' ' LEU . 67.7 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 122.058 0.932 . . . . 0.0 113.082 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 122.151 0.976 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -58.52 -26.31 63.36 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.095 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -55.23 -10.42 0.56 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -75.76 -27.74 58.18 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.549 -0.72 . . . . 0.0 111.687 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -58.55 -44.07 89.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.389 0.614 . . . . 0.0 109.786 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -71.16 -36.08 71.88 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 745' ' ' SER . . . . . 0.717 ' O ' HD12 ' C' ' 748' ' ' LEU . 9.6 t -56.78 -38.71 72.88 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.687 HG22 HG21 ' B' ' 781' ' ' ILE . 6.0 mt -52.97 -22.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.84 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -59.35 -27.6 66.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.761 HD13 ' N ' ' C' ' 749' ' ' VAL . 0.0 OUTLIER -57.03 -22.54 39.65 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 122.185 -0.322 . . . . 0.0 111.606 179.247 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 749' ' ' VAL . . . . . 0.761 ' N ' HD13 ' C' ' 748' ' ' LEU . 83.5 t -55.41 -54.25 27.22 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.466 ' OD1' HD22 ' B' ' 785' ' ' LEU . 6.7 m120 -72.77 -32.03 65.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.166 -1.379 . . . . 0.0 108.792 174.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.46 -20.65 38.52 Favored Glycine 0 C--N 1.341 0.834 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.806 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 80.6 p -58.77 -37.97 77.45 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.766 -0.843 . . . . 0.0 109.025 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.8 tp -67.34 -48.15 68.37 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.764 0.792 . . . . 0.0 109.986 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.14 77.13 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.427 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.7 tt -59.29 -45.32 91.59 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.858 -0.526 . . . . 0.0 111.976 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 3.2 pt -73.96 -32.88 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.32 0.581 . . . . 0.0 109.822 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -69.29 -30.32 68.39 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.805 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -55.71 -49.01 74.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.347 -0.846 . . . . 0.0 109.907 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -70.2 -44.45 68.66 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.362 0.601 . . . . 0.0 111.29 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.4 -40.6 97.01 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 111.463 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -78.45 -32.81 48.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.022 0.439 . . . . 0.0 111.405 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 37.5 t -66.63 -43.27 85.13 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.282 1.039 . . . . 0.0 110.063 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.495 HD23 HD11 ' C' ' 771' ' ' LEU . 3.2 tp -64.88 -53.57 44.59 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.08 -0.964 . . . . 0.0 113.387 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.532 ' HB2' HD12 ' C' ' 771' ' ' LEU . 23.3 t -97.82 -20.51 17.48 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 64.29 -75.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.745 0.307 . . . . 0.0 110.5 -177.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -108.5 -72.93 0.7 Allowed 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.476 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 23.6 t -133.86 175.71 9.21 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.518 0.675 . . . . 0.0 111.332 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -58.39 -38.3 77.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.152 0.501 . . . . 0.0 110.584 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -53.34 -46.49 69.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 122.105 0.955 . . . . 0.0 108.8 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 48.2 ttm-85 -72.45 -29.57 63.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.953 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' C' ' 764' ' ' SER . 7.5 tt -58.68 -29.66 66.78 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -178.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -56.39 -32.69 65.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -69.36 -34.52 74.7 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 118.382 -1.327 . . . . 0.0 109.666 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.595 HD21 ' CZ ' ' A' ' 742' ' ' ARG . 0.2 OUTLIER -59.93 -38.42 82.33 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.35 -36.08 72.9 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.324 1.059 . . . . 0.0 108.304 176.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -37.6 65.82 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.221 178.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.591 HD12 HD22 ' C' ' 774' ' ' LEU . 23.1 mt -63.64 -44.92 98.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.501 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.565 ' O ' HG13 ' C' ' 782' ' ' VAL . 34.5 m -66.25 -40.86 87.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.229 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.425 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.1 m -63.14 -47.14 84.0 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.984 0.421 . . . . 0.0 111.881 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -39.23 83.93 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.813 -0.554 . . . . 0.0 111.871 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.405 ' HB ' HG21 ' A' ' 746' ' ' ILE . 94.3 mt -68.95 -41.94 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.768 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.781 HG12 HG21 ' A' ' 749' ' ' VAL . 26.4 m -55.89 -38.05 50.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.744 0 CA-C-N 119.773 1.169 . . . . 0.0 109.418 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 . . . . . 0 C--N 1.344 0.359 0 CA-C-O 121.699 0.762 . . . . 0.0 110.052 178.804 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.586 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 28.1 mt 77.61 112.23 0.07 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.989 0.9 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -176.29 -175.76 0.72 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.507 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.2 tt -56.07 -42.17 76.27 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.61 -0.681 . . . . 0.0 110.216 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.02 -34.48 64.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.125 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -73.96 -46.03 46.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.105 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -70.03 -45.95 66.1 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.976 0.417 . . . . 0.0 110.934 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.78 -26.55 65.27 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.985 0.421 . . . . 0.0 111.886 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.6 m -69.29 -32.26 71.29 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.292 0.568 . . . . 0.0 111.195 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.47 -31.71 72.48 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.447 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -59.61 -21.95 61.13 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.031 0.443 . . . . 0.0 111.267 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -75.09 -20.75 59.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.093 0.473 . . . . 0.0 111.432 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.83 -42.57 99.19 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.436 0.636 . . . . 0.0 110.973 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.4 t80 60.22 39.75 18.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.838 0.828 . . . . 0.0 110.848 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -160.98 -67.2 0.06 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.842 -0.536 . . . . 0.0 111.296 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.19 -37.13 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 122.131 -0.356 . . . . 0.0 111.83 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.0 m -52.31 -34.36 46.66 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -177.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -65.02 -49.89 68.41 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 121.507 0.67 . . . . 0.0 109.83 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.4 t90 -65.6 -41.22 93.02 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.675 0.75 . . . . 0.0 110.146 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.423 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -66.17 -36.44 83.11 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.283 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -94.56 -40.16 10.0 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -74.12 -2.7 25.65 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.692 -0.63 . . . . 0.0 112.556 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.685 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.98 -36.94 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 121.646 -0.659 . . . . 0.0 110.284 179.458 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.685 ' H ' HD12 ' A' ' 682' ' ' ILE . 5.9 ttt-85 -59.49 -47.26 86.19 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.009 -0.432 . . . . 0.0 110.584 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.411 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -66.76 -34.6 71.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.42 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.4 OUTLIER -59.95 -32.05 70.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.483 -179.544 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 1.004 HD12 HG21 ' C' ' 686' ' ' ILE . 15.7 mm -60.61 -46.73 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.988 0.423 . . . . 0.0 110.216 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 83.8 mt -60.78 -40.36 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.92 -37.03 70.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.107 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 685' ' ' PHE . 97.9 t -54.58 -40.02 48.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.6 -39.94 95.75 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.9 m -63.4 -38.44 91.14 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.806 0.812 . . . . 0.0 109.694 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.6 -43.95 93.55 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.327 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.866 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -68.31 -42.05 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.007 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.03 -22.5 57.94 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.91 -37.72 85.69 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.999 0.904 . . . . 0.0 109.306 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 2.4 mmt180 -55.51 -28.16 53.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.569 0.748 . . . . 0.0 111.618 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.03 -39.19 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 O-C-N 121.292 -0.88 . . . . 0.0 108.794 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.805 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.53 -31.26 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 O-C-N 121.582 -0.699 . . . . 0.0 110.184 177.219 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.422 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 3.1 m-85 -56.01 -28.91 59.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.962 0.411 . . . . 0.0 110.607 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.48 -37.43 72.91 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.805 HG22 ' O ' ' A' ' 698' ' ' VAL . 10.3 m -59.29 -35.87 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.539 0.685 . . . . 0.0 109.313 177.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.4 -37.81 62.82 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.525 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.5 m -62.65 -39.49 94.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.607 0.718 . . . . 0.0 110.091 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.576 HD22 HH22 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.03 -41.93 97.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.558 1.17 . . . . 0.0 108.804 178.785 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 99.0 t -68.87 -37.07 76.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.317 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -62.56 -39.92 95.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.034 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.576 HH22 HD22 ' A' ' 704' ' ' LEU . 5.2 ttm105 -57.36 -48.44 79.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 122.348 1.071 . . . . 0.0 110.349 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -72.94 -44.53 57.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.022 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -73.33 -14.47 61.3 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -178.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -99.62 8.35 44.47 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 73.14 20.79 80.06 Favored Glycine 0 CA--C 1.541 1.687 0 O-C-N 121.665 -0.647 . . . . 0.0 112.131 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 68.22 -129.29 0.12 Allowed 'General case' 0 CA--C 1.568 1.635 0 O-C-N 121.868 -0.783 . . . . 0.0 111.272 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 5.5 p -62.62 159.26 44.54 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 120.974 -1.078 . . . . 0.0 111.206 -178.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -45.15 97.96 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.46 1.44 . . . . 0.0 112.127 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.61 -20.41 16.35 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.423 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.85 0 O-C-N 121.766 -0.584 . . . . 0.0 112.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 121.917 0.865 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.7 mtt-85 -58.63 -26.33 63.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.746 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -54.85 -16.97 3.02 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.8 -0.563 . . . . 0.0 111.225 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.532 ' O ' HD12 ' A' ' 746' ' ' ILE . 53.1 ttp85 -74.79 -46.01 39.75 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.759 -0.588 . . . . 0.0 110.527 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.91 -45.14 93.51 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.504 0.669 . . . . 0.0 110.587 -178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.41 -36.56 71.38 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 745' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 748' ' ' LEU . 98.0 p -62.22 -36.14 81.03 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.703 HG12 HG12 ' C' ' 778' ' ' VAL . 1.2 mp -55.79 -46.76 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 120.577 -1.327 . . . . 0.0 110.283 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.435 ' NH2' HG12 ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.41 -2.2 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.758 -177.165 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.65 ' O ' HD13 ' A' ' 748' ' ' LEU . 1.7 tm? -59.33 -15.53 16.82 Favored 'General case' 0 C--N 1.368 1.398 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 746' ' ' ILE 0.304 2.0 t -53.12 -54.0 19.57 Favored 'Isoleucine or valine' 0 C--N 1.345 0.375 0 C-N-CA 125.13 1.372 . . . . 0.0 107.439 178.478 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.467 ' OD1' HG12 ' A' ' 749' ' ' VAL . 6.4 m120 -73.32 -14.34 61.28 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.324 175.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.608 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -57.16 -19.41 31.54 Favored Glycine 0 C--O 1.222 -0.622 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.519 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 94.0 p -57.64 -37.86 74.06 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 117.803 0.801 . . . . 0.0 109.147 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.4 tp -62.55 -51.07 68.84 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.8 -35.14 79.63 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 112.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.4 tt -59.48 -45.45 91.61 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.002 -0.436 . . . . 0.0 111.963 -177.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.2 mt -61.84 -33.52 58.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.2 -30.49 68.68 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.536 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 5.1 m-20 -55.68 -48.93 74.23 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.319 -0.863 . . . . 0.0 109.271 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -70.64 -43.46 69.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.405 0.622 . . . . 0.0 111.757 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.42 -32.97 74.81 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.308 0.575 . . . . 0.0 112.114 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -74.42 -18.55 60.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.2 t -77.37 -46.4 22.93 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.579 -0.7 . . . . 0.0 111.634 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.745 ' HA ' HD13 ' A' ' 774' ' ' LEU . 8.0 mp -69.09 -55.82 9.59 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -47.24 5.19 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.255 1.026 . . . . 0.0 112.15 -178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.431 ' O ' HD23 ' A' ' 765' ' ' LEU . 3.6 tt 84.22 -52.96 0.12 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.464 -176.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -134.43 -72.6 0.48 Allowed 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.78 -0.575 . . . . 0.0 110.668 178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.9 152.93 19.83 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.884 -0.51 . . . . 0.0 110.323 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.511 ' CE2' HD13 ' A' ' 771' ' ' LEU . 0.2 OUTLIER -67.03 -24.86 66.05 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.942 0.401 . . . . 0.0 110.897 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.18 -42.19 65.99 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.731 0.777 . . . . 0.0 109.54 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -62.95 -30.08 71.29 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.114 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.511 HD13 ' CE2' ' A' ' 768' ' ' TYR . 2.8 tt -59.87 -42.4 93.63 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.859 -0.525 . . . . 0.0 109.709 -178.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -64.72 -33.51 76.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.658 0.742 . . . . 0.0 109.236 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -43.44 98.82 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.919 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.745 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.7 tt -58.38 -38.46 77.36 Favored 'General case' 0 C--N 1.349 0.544 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.172 -179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 13.1 mt -58.44 -36.88 74.34 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.774 -0.579 . . . . 0.0 112.028 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.8 -43.07 72.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.914 -0.491 . . . . 0.0 112.173 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 20.5 pt -65.19 -37.69 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.466 ' HA ' HD12 ' A' ' 781' ' ' ILE . 73.0 t -56.09 -45.42 80.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 O-C-N 121.98 -0.45 . . . . 0.0 110.631 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.827 ' O ' HG22 ' A' ' 782' ' ' VAL . 19.9 p -63.62 -48.39 77.49 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.023 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -67.54 -31.34 71.37 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.629 ' CD1' HD13 ' B' ' 746' ' ' ILE . 36.8 mt -53.66 -36.21 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.827 HG22 ' O ' ' A' ' 779' ' ' THR . 5.2 m -55.63 -37.99 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.368 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -65.45 -44.68 86.51 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 121.503 0.668 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 13.1 tp -69.45 -38.2 77.68 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.158 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.516 0 CA-C-O 121.0 0.429 . . . . 0.0 111.475 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.581 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.5 mm? 63.53 119.6 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.624 0.726 . . . . 0.0 110.055 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 178.57 177.55 0.45 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.479 0.657 . . . . 0.0 110.172 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.485 HD23 ' N ' ' B' ' 664' ' ' ASP . 9.5 tt -48.94 -62.52 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.793 0.806 . . . . 0.0 111.379 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.485 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.0 t70 -64.78 -21.16 66.72 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.408 -178.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -79.97 -43.91 21.19 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.924 -0.485 . . . . 0.0 110.677 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -64.81 -46.09 83.47 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.665 0.745 . . . . 0.0 109.964 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.09 -23.74 67.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.771 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 42.8 p -68.45 -30.84 69.79 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.838 -0.539 . . . . 0.0 111.274 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.0 -33.19 72.86 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.485 0.659 . . . . 0.0 110.779 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 64.3 m95 -59.57 -18.87 44.43 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.366 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -84.92 -29.5 25.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.343 0.592 . . . . 0.0 110.744 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.7 m95 -57.6 -47.56 81.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.354 0.597 . . . . 0.0 110.74 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 18.8 t80 59.52 28.11 17.43 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.334 0.588 . . . . 0.0 111.323 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -138.68 -78.23 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.83 -0.544 . . . . 0.0 111.069 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -64.64 -36.98 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.681 -0.637 . . . . 0.0 111.254 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.81 -34.31 39.6 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.073 -0.392 . . . . 0.0 111.916 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -63.36 -50.15 71.08 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 109.575 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.624 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.6 t90 -65.65 -40.58 92.61 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-O 121.889 0.852 . . . . 0.0 109.879 178.152 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -35.68 81.61 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.322 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -101.83 -47.01 4.74 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -59.0 -15.1 11.45 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.61 -0.681 . . . . 0.0 112.224 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.783 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.3 pp -60.56 -36.28 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.623 -0.673 . . . . 0.0 110.459 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 683' ' ' ARG . . . . . 0.783 ' N ' HD12 ' B' ' 682' ' ' ILE . 12.9 ttt-85 -53.85 -47.39 71.01 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.442 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -68.68 -37.34 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -28.25 67.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.786 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.707 HD12 HG21 ' A' ' 686' ' ' ILE . 16.9 mm -60.7 -49.6 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 O-C-N 121.781 -0.575 . . . . 0.0 109.924 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.37 -39.59 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.09 -37.95 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.66 -48.4 87.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.16 -26.75 9.51 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 7.4 m -60.06 -43.85 95.14 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.579 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.56 -31.84 69.8 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.413 -0.805 . . . . 0.0 112.374 -177.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.579 ' N ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.05 -46.13 84.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.452 -0.78 . . . . 0.0 109.757 -177.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.73 -31.36 77.79 Favored Glycine 0 CA--C 1.54 1.624 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.455 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.08 -37.19 66.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.906 0.86 . . . . 0.0 110.434 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.866 ' HE ' HD11 ' A' ' 693' ' ' ILE . 17.3 mmt180 -55.14 -28.23 51.17 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.703 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.53 -36.55 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 O-C-N 120.813 -1.179 . . . . 0.0 108.665 -178.208 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.455 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.4 -30.84 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.418 -0.801 . . . . 0.0 109.65 176.472 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.7 m-85 -56.37 -30.64 62.95 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.759 -0.588 . . . . 0.0 109.724 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.64 -37.4 75.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -43.16 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -59.69 -37.97 80.28 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.121 0.486 . . . . 0.0 109.767 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.3 m -62.76 -32.96 74.21 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.219 0.533 . . . . 0.0 109.594 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.1 OUTLIER -64.18 -40.59 96.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.052 0.929 . . . . 0.0 108.617 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.495 HG22 HD22 ' B' ' 748' ' ' LEU . 58.6 t -67.88 -46.17 82.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.564 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.87 -36.61 83.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.8 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.34 -50.18 55.11 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -41.98 30.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.645 0.736 . . . . 0.0 112.434 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -58.01 -44.99 87.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.514 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.413 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.2 pt20 -104.61 -25.0 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.333 1.063 . . . . 0.0 113.24 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.95 153.55 8.0 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.511 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -85.85 -33.24 21.35 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 122.05 -0.676 . . . . 0.0 112.135 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.02 155.43 52.49 Favored Pre-proline 0 N--CA 1.471 0.601 0 CA-C-O 118.454 -0.784 . . . . 0.0 109.663 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 708' ' ' VAL . 59.8 Cg_exo -36.83 138.24 0.23 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.809 1.673 . . . . 0.0 112.285 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' B' ' 716' ' ' SER . 11.4 tp -100.55 -19.3 16.22 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 715' ' ' LEU . 6.9 t . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 122.346 1.07 . . . . 0.0 112.756 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.547 0.833 0 CA-C-O 122.045 0.926 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 3.1 ttp85 -72.42 -26.22 61.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.898 0.856 . . . . 0.0 111.454 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.32 -6.09 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -176.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.829 ' O ' HD12 ' B' ' 746' ' ' ILE . 60.8 mtm-85 -55.33 -39.11 69.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.248 0.931 . . . . 0.0 110.492 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.16 -43.72 87.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.165 0.507 . . . . 0.0 109.82 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.3 -42.86 68.14 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.567 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 93.8 p -56.54 -37.75 70.93 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.862 -0.524 . . . . 0.0 110.903 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.829 HD12 ' O ' ' B' ' 742' ' ' ARG . 1.4 mp -58.99 -10.28 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.836 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.429 ' HD2' ' HG3' ' C' ' 714' ' ' PRO . 0.0 OUTLIER -59.0 -27.11 65.12 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 121.211 -0.93 . . . . 0.0 108.863 177.683 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.495 HD22 HG22 ' B' ' 705' ' ' VAL . 33.9 tp -54.47 -21.91 11.27 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.643 -177.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 92.4 t -55.39 -54.29 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -73.02 -24.7 60.76 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.282 174.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.95 -19.76 31.25 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.025 -0.989 . . . . 0.0 113.159 -176.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 35.6 t -58.17 -37.63 75.08 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.387 1.094 . . . . 0.0 108.993 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 33.1 tp -69.27 -51.07 41.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.152 0.501 . . . . 0.0 110.595 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.63 76.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.78 -45.37 92.51 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.574 -0.704 . . . . 0.0 111.852 -176.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 756' ' ' ILE . . . . . 0.41 HG22 HD12 ' B' ' 760' ' ' LEU . 32.1 mm -64.99 -31.2 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.584 0.707 . . . . 0.0 109.24 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.39 68.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.947 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.21 -49.15 72.67 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.295 -0.878 . . . . 0.0 108.755 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.67 -44.6 66.69 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.455 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 760' ' ' LEU . . . . . 0.41 HD12 HG22 ' B' ' 756' ' ' ILE . 24.6 mt -68.1 -46.27 71.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -177.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -63.38 -42.77 98.86 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 762' ' ' SER . . . . . 0.406 ' O ' HD22 ' B' ' 774' ' ' LEU . 2.1 p -68.42 -45.45 72.58 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.443 0.639 . . . . 0.0 111.073 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.446 HD23 HD11 ' B' ' 771' ' ' LEU . 0.2 OUTLIER -68.67 -53.75 20.45 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.829 -0.544 . . . . 0.0 112.39 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.9 p -98.03 -49.35 4.79 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 76.89 92.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.898 0.856 . . . . 0.0 110.412 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 3.1 t80 71.45 -72.93 0.1 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.177 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 19.2 p -98.67 163.28 12.71 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.743 -0.598 . . . . 0.0 111.376 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.87 -33.51 21.24 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.661 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.81 -38.11 64.23 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 122.167 0.984 . . . . 0.0 109.156 178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 9.6 tpt85 -59.27 -29.64 67.72 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.856 178.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.446 HD11 HD23 ' B' ' 763' ' ' LEU . 8.0 tt -59.61 -37.73 79.39 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 110.706 -178.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -58.53 -35.62 72.57 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.128 0.49 . . . . 0.0 110.081 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -69.25 -48.98 60.32 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.138 0.494 . . . . 0.0 110.188 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.413 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.1 OUTLIER -61.4 -37.73 84.5 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.747 0.784 . . . . 0.0 110.137 179.539 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.62 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.6 OUTLIER -57.69 -36.92 72.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.58 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.15 -33.28 69.9 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 122.19 -0.319 . . . . 0.0 111.45 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 6.3 pt -70.15 -36.88 69.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 O-C-N 121.839 -0.538 . . . . 0.0 110.317 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.413 HG23 ' O ' ' B' ' 774' ' ' LEU . 41.6 t -59.72 -46.19 93.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 O-C-N 121.526 -0.734 . . . . 0.0 110.344 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.791 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.2 t -63.33 -48.18 79.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.934 -0.479 . . . . 0.0 112.226 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.5 -31.68 71.96 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.756 -0.59 . . . . 0.0 111.445 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 22.6 mt -58.34 -36.32 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 121.88 -0.513 . . . . 0.0 110.652 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.791 HG22 ' O ' ' B' ' 779' ' ' THR . 5.9 m -53.87 -38.26 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 O-C-N 121.593 -0.692 . . . . 0.0 110.246 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.28 -41.61 96.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.4 0.619 . . . . 0.0 110.573 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.73 -44.13 97.5 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.295 0.569 . . . . 0.0 110.954 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 30.3 tp -79.51 -24.95 41.91 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.007 0.432 . . . . 0.0 110.64 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.51 -43.04 10.43 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -97.78 113.66 25.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.686 0.755 . . . . 0.0 109.776 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.348 -178.564 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 122.398 1.094 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.54 169.26 24.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.884 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -174.58 167.41 3.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.572 0.701 . . . . 0.0 110.532 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.588 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.2 OUTLIER -56.2 -48.69 75.9 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.067 0.937 . . . . 0.0 109.375 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.588 ' N ' HD13 ' C' ' 663' ' ' LEU . 9.4 t70 -67.2 -28.96 68.51 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.396 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -71.22 -48.74 49.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.028 0.442 . . . . 0.0 111.018 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -56.84 -46.19 81.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.217 0.532 . . . . 0.0 110.486 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.35 85.65 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.185 0.516 . . . . 0.0 111.448 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 25.5 p -57.78 -34.5 69.65 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.138 0.495 . . . . 0.0 111.293 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 14.8 mt -60.52 -29.06 68.87 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.139 -0.351 . . . . 0.0 111.293 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 51.1 m95 -60.91 -21.11 63.05 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.909 -0.495 . . . . 0.0 110.993 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -84.98 -5.76 59.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 121.03 0.443 . . . . 0.0 111.352 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.43 ' O ' HG22 ' C' ' 675' ' ' ILE . 13.9 m95 -89.86 30.65 1.03 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.323 0.582 . . . . 0.0 110.617 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -16.56 135.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 91.52 -48.93 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.688 1.595 . . . . 0.0 111.651 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.662 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.82 -42.39 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.535 0.683 . . . . 0.0 111.571 -179.34 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.73 -33.69 49.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.568 -178.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -60.11 -49.92 75.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.391 0.615 . . . . 0.0 109.704 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.8 OUTLIER -65.81 -42.76 90.25 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.685 0.755 . . . . 0.0 109.693 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.466 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -63.31 -35.8 81.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.391 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -101.61 -23.27 14.29 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -83.09 -16.07 48.33 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.374 -0.829 . . . . 0.0 112.22 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.5 pp -60.53 -36.47 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 O-C-N 122.043 -0.411 . . . . 0.0 110.226 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.645 ' N ' HD12 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -59.88 -46.86 87.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.75 0.786 . . . . 0.0 109.789 179.397 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.434 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -73.18 -31.33 34.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 CA-C-O 121.423 0.63 . . . . 0.0 109.71 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -28.28 68.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.436 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 1.004 HG21 HD12 ' A' ' 686' ' ' ILE . 8.3 mm -61.79 -42.74 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 121.41 0.624 . . . . 0.0 109.562 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 66.4 mt -65.19 -37.64 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.92 -38.23 72.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 81.6 t -55.7 -40.41 60.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 690' ' ' GLY . . . . . 0.424 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.13 -40.43 74.42 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 177.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.6 m -66.35 -38.32 87.34 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.019 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.0 tp -60.21 -46.32 90.16 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.572 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.424 HG13 ' O ' ' C' ' 690' ' ' GLY . 1.9 pp -67.88 -41.8 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 O-C-N 121.928 -0.483 . . . . 0.0 111.005 -178.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.698 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.39 -26.57 64.36 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.9 tt -66.07 -38.74 89.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.938 0.875 . . . . 0.0 110.138 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.15 -28.69 58.97 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.698 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.2 tt -58.77 -35.36 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 O-C-N 121.416 -0.802 . . . . 0.0 110.99 -176.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.9 p -53.89 -29.77 18.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 O-C-N 121.495 -0.753 . . . . 0.0 110.474 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -55.91 -31.68 63.1 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.873 -0.517 . . . . 0.0 110.268 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.82 -37.64 79.76 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -45.13 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -56.69 -39.12 73.25 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.753 178.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.4 m -63.33 -38.84 92.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.997 0.427 . . . . 0.0 110.144 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.447 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.2 OUTLIER -63.19 -41.98 99.28 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.254 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.741 HG13 HD21 ' C' ' 748' ' ' LEU . 98.8 t -61.69 -45.61 98.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.84 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.274 1.035 . . . . 0.0 111.055 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.413 ' HD2' ' C ' ' C' ' 707' ' ' ARG . 5.6 tmm_? -57.08 -51.06 70.79 Favored 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 121.301 -0.874 . . . . 0.0 110.654 -177.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -44.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -73.05 -44.19 61.03 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -103.28 -22.05 13.76 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.52 164.74 11.62 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' B' ' 704' ' ' LEU . 31.4 p90 -114.08 -47.62 2.94 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.474 0.654 . . . . 0.0 111.779 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 9.7 p -97.99 159.5 30.68 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 714' ' ' PRO . . . . . 0.429 ' HG3' ' HD2' ' B' ' 747' ' ' ARG . 27.3 Cg_exo -33.47 121.35 0.12 Allowed 'Trans proline' 0 N--CA 1.5 1.86 0 C-N-CA 122.19 1.927 . . . . 0.0 112.424 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.76 16.61 23.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 O-C-N 121.004 -1.06 . . . . 0.0 110.031 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 N--CA 1.467 0.419 0 CA-C-O 121.935 0.874 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 17.8 tpt85 -64.26 -30.73 71.77 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.333 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.75 -34.03 64.83 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.039 0.447 . . . . 0.0 111.05 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -58.1 -37.41 74.47 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.191 -0.318 . . . . 0.0 111.635 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -58.27 -39.28 78.81 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.461 -0.774 . . . . 0.0 108.975 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -36.46 71.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.376 177.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 54.2 p -61.7 -44.8 96.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.9 -0.5 . . . . 0.0 110.924 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.57 -28.67 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.286 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 4.9 mtm105 -59.81 -22.81 62.7 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.55 -0.719 . . . . 0.0 110.021 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.741 HD21 HG13 ' C' ' 705' ' ' VAL . 0.1 OUTLIER -67.11 -18.58 65.37 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.031 0.444 . . . . 0.0 110.18 178.427 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 46.4 t -55.74 -54.66 23.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.579 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -72.9 -21.07 60.97 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.338 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.86 -20.19 32.25 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.518 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.1 p -58.15 -37.62 74.99 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.909 -0.76 . . . . 0.0 109.103 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 13.6 tp -65.63 -51.32 60.48 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 754' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.01 -34.91 72.43 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.356 0.598 . . . . 0.0 111.854 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.476 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.5 tt -59.04 -45.34 90.98 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.0 0.429 . . . . 0.0 111.302 -177.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 50.9 mt -72.08 -37.28 59.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.509 0.671 . . . . 0.0 109.689 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.33 -31.42 69.85 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.78 -45.88 78.05 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.146 -0.971 . . . . 0.0 110.241 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 759' ' ' ASP . . . . . 0.721 ' O ' HD12 ' C' ' 763' ' ' LEU . 22.8 t70 -70.29 -42.86 71.5 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.427 0.632 . . . . 0.0 110.976 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.31 -36.81 83.88 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -82.41 -31.37 29.64 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 68.9 m -73.37 -45.84 52.62 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.538 -0.726 . . . . 0.0 112.751 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.77 HD13 ' H ' ' C' ' 764' ' ' SER . 0.0 OUTLIER -68.57 -39.0 81.2 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.689 -0.632 . . . . 0.0 112.61 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.77 ' H ' HD13 ' C' ' 763' ' ' LEU . 4.9 m -91.26 -34.27 15.03 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.832 -0.543 . . . . 0.0 111.53 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.06 60.88 1.43 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 122.304 1.05 . . . . 0.0 109.438 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.6 t80 60.53 160.53 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.327 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 50.4 m 55.69 -160.02 0.2 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -132.83 -34.39 1.14 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.371 -0.83 . . . . 0.0 110.463 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -53.5 -27.55 26.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.682 0.753 . . . . 0.0 109.888 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.48 -30.14 65.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.46 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.564 HD12 HD21 ' C' ' 763' ' ' LEU . 6.2 tt -59.66 -30.84 69.03 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.842 -0.536 . . . . 0.0 110.038 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -32.83 67.76 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.657 0.742 . . . . 0.0 109.2 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.33 -34.37 77.56 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.516 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.519 HD13 ' HA ' ' C' ' 763' ' ' LEU . 9.0 tp -57.88 -38.35 75.62 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 121.804 -0.56 . . . . 0.0 110.287 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 49.8 mt -58.44 -39.47 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.769 0.795 . . . . 0.0 109.814 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.56 -41.69 60.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.666 0.746 . . . . 0.0 110.691 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.13 -41.57 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.02 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.703 HG12 HG12 ' A' ' 746' ' ' ILE . 27.9 m -65.09 -39.69 86.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 O-C-N 121.514 -0.741 . . . . 0.0 110.766 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.759 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.0 OUTLIER -63.72 -45.19 91.07 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 122.041 -0.412 . . . . 0.0 111.489 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -31.63 71.62 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.552 HD13 ' HB ' ' A' ' 746' ' ' ILE . 61.4 mt -64.54 -39.44 85.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 119.051 -0.5 . . . . 0.0 112.157 -178.092 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.759 HG22 ' O ' ' C' ' 779' ' ' THR . 29.2 m -53.16 -37.95 29.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 CA-C-N 119.846 1.203 . . . . 0.0 110.126 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 121.157 0.503 . . . . 0.0 111.446 179.886 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.658 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.8 tp . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 61.4 mt 56.32 92.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.861 0.838 . . . . 0.0 110.927 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -164.58 178.14 7.57 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.054 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.464 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.9 tt -54.79 -43.93 73.28 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.579 0.704 . . . . 0.0 110.441 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.38 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -73.95 -45.46 50.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.197 0.522 . . . . 0.0 110.943 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -70.18 -46.34 64.81 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.803 0.335 . . . . 0.0 111.174 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.75 -28.38 68.99 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.022 0.439 . . . . 0.0 112.159 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.3 t -65.35 -36.84 85.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.367 0.603 . . . . 0.0 111.022 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.5 HD23 ' OG1' ' A' ' 676' ' ' THR . 0.7 OUTLIER -65.48 -23.65 66.96 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -59.62 -27.85 66.68 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.497 -0.752 . . . . 0.0 111.508 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -67.46 -24.03 65.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.883 -0.51 . . . . 0.0 111.625 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -54.96 -47.58 74.34 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.232 0.539 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 76.3 t80 60.77 7.49 1.46 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -118.01 -73.77 0.63 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.172 -0.955 . . . . 0.0 111.091 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.62 HG12 HD23 ' A' ' 679' ' ' LEU . 5.7 tt -68.06 -36.02 73.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 O-C-N 121.959 -0.463 . . . . 0.0 111.78 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.5 ' OG1' HD23 ' A' ' 669' ' ' LEU . 4.3 m -50.99 -33.58 25.35 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 122.033 -0.417 . . . . 0.0 111.351 -176.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.88 -49.2 75.79 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.544 0.688 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.545 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -65.51 -44.29 87.46 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 121.659 -0.651 . . . . 0.0 110.498 179.398 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.62 HD23 HG12 ' A' ' 675' ' ' ILE . 3.4 mm? -66.18 -39.36 89.66 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.2 t90 -89.27 -8.49 53.3 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -107.67 -8.5 16.1 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.551 -0.718 . . . . 0.0 111.833 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 678' ' ' TRP . 1.6 pt -60.53 -36.67 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 121.665 -0.647 . . . . 0.0 109.412 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.6 ttt-85 -53.45 -47.14 69.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 109.814 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.18 -36.09 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.451 ' O ' HG23 ' A' ' 689' ' ' VAL . 1.2 t80 -59.83 -28.59 67.61 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.485 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 14.1 mm -61.67 -51.98 66.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.358 0.599 . . . . 0.0 109.76 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.18 -36.46 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.728 0.775 . . . . 0.0 109.384 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -36.95 58.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.9 t -54.06 -40.07 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.21 -39.67 82.08 Favored Glycine 0 CA--C 1.532 1.119 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.28 -38.51 85.18 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.116 0.96 . . . . 0.0 109.596 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.64 -46.12 89.97 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.172 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.55 HG21 HG22 ' B' ' 693' ' ' ILE . 1.4 pp -68.15 -43.29 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 122.045 -0.41 . . . . 0.0 111.333 -177.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.68 -23.43 60.88 Favored Glycine 0 CA--C 1.54 1.596 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.31 -37.98 79.11 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.256 1.027 . . . . 0.0 108.957 178.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.674 ' HG3' HD11 ' C' ' 693' ' ' ILE . 15.5 mmt180 -55.99 -28.45 57.24 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.599 0.76 . . . . 0.0 112.541 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.36 -41.27 83.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.366 -0.833 . . . . 0.0 109.206 -177.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.755 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.51 -30.37 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.501 -0.75 . . . . 0.0 109.956 177.135 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.49 -28.56 55.31 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.255 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -37.01 71.3 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.9 m -58.83 -36.76 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 O-C-N 121.59 -0.694 . . . . 0.0 109.316 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -56.15 -38.22 70.55 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 19.4 m -64.06 -39.3 93.78 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-O 121.563 0.697 . . . . 0.0 109.922 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.503 HD22 ' NH1' ' A' ' 707' ' ' ARG . 0.5 OUTLIER -60.84 -44.72 96.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.571 1.176 . . . . 0.0 108.533 178.337 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.984 HG22 HD11 ' A' ' 748' ' ' LEU . 40.1 t -64.36 -42.86 96.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 114.411 -1.268 . . . . 0.0 109.128 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.59 -42.12 99.37 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.285 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.503 ' NH1' HD22 ' A' ' 704' ' ' LEU . 8.6 mtm105 -60.89 -45.8 93.17 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.138 0.971 . . . . 0.0 111.474 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.435 HG21 ' HA ' ' B' ' 713' ' ' SER . 3.0 t -75.89 -44.66 38.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.221 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -73.76 -14.69 61.16 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -90.82 -16.23 28.66 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.04 -1.037 . . . . 0.0 113.06 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.98 34.36 3.49 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 121.639 -0.663 . . . . 0.0 111.98 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 55.58 -136.03 1.27 Allowed 'General case' 0 CA--C 1.561 1.4 0 O-C-N 122.031 -0.688 . . . . 0.0 110.828 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 17.1 m -62.86 157.76 57.78 Favored Pre-proline 0 C--N 1.35 0.611 0 O-C-N 120.859 -1.151 . . . . 0.0 112.106 -178.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.433 ' HD2' HG21 ' C' ' 708' ' ' VAL . 73.0 Cg_exo -44.6 103.89 0.05 OUTLIER 'Trans proline' 0 N--CA 1.482 0.815 0 C-N-CA 121.763 1.642 . . . . 0.0 112.799 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.541 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.9 pt? -105.95 -20.61 13.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.564 0.697 . . . . 0.0 111.594 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.692 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 C-N-CA 123.378 0.671 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 14.0 ttm-85 -59.3 -26.73 65.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.481 -179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -9.06 0.65 Allowed 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.746 -0.596 . . . . 0.0 112.389 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.4 ttm105 -60.0 -41.73 92.72 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.411 -0.805 . . . . 0.0 109.48 179.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.593 ' HB3' HD12 ' C' ' 781' ' ' ILE . 0.9 OUTLIER -68.08 -41.11 82.38 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.534 0.683 . . . . 0.0 109.335 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -60.04 -46.83 88.23 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.279 -0.888 . . . . 0.0 108.955 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.8 p -69.15 -26.94 65.12 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.55 ' HB ' HG21 ' C' ' 781' ' ' ILE . 30.7 mt -74.89 -47.41 37.43 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-O 116.565 -1.683 . . . . 0.0 112.014 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.514 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.343 14.1 ttt180 -73.45 -3.85 30.04 Favored 'General case' 0 C--N 1.361 1.109 0 CA-C-N 122.721 2.509 . . . . 0.0 111.47 -178.91 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.984 HD11 HG22 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -56.46 -15.4 4.14 Favored 'General case' 0 CA--C 1.577 1.992 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 169.601 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.425 HG12 ' OD1' ' A' ' 750' ' ' ASN 0.293 1.5 t -53.66 -54.2 20.81 Favored 'Isoleucine or valine' 0 C--N 1.363 1.182 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 175.172 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 750' ' ' ASN . . . . . 0.425 ' OD1' HG12 ' A' ' 749' ' ' VAL . 6.5 m120 -72.52 -22.43 61.03 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.158 -1.383 . . . . 0.0 108.686 175.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.87 -19.39 29.26 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.1 t -57.45 -37.11 72.3 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 51.6 tp -61.31 -49.25 77.76 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.0 -34.75 72.21 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.657 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.474 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.2 tt -58.67 -45.53 89.18 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.876 -0.515 . . . . 0.0 112.189 -176.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 40.3 mt -61.55 -32.24 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.24 -30.38 68.51 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.76 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.71 ' OD2' HD22 ' B' ' 715' ' ' LEU . 6.3 m-20 -55.51 -44.9 77.03 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.855 0.836 . . . . 0.0 109.248 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -70.41 -42.84 71.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.573 0.701 . . . . 0.0 111.372 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 22.6 mt -68.98 -29.85 68.14 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -79.16 -30.13 43.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.9 t -75.26 -45.02 42.71 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.951 0.881 . . . . 0.0 111.61 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.65 ' O ' HD22 ' A' ' 774' ' ' LEU . 0.5 OUTLIER -59.9 -53.59 56.06 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.232 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 3.3 m -97.9 -24.11 15.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.353 -0.842 . . . . 0.0 113.237 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.6 mt 66.55 -73.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.906 0.384 . . . . 0.0 109.989 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -135.8 133.76 38.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 109.516 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m 58.48 168.74 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.506 ' CE1' HD22 ' A' ' 771' ' ' LEU . 5.2 t80 -91.14 -17.56 25.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 120.963 0.411 . . . . 0.0 111.813 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.8 -34.0 77.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.004 0.907 . . . . 0.0 109.773 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -62.64 -29.53 70.7 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.003 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.529 HD11 HD23 ' A' ' 763' ' ' LEU . 40.2 tp -59.61 -45.52 91.68 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.891 -0.506 . . . . 0.0 111.928 -177.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 1.3 ptt85 -64.02 -33.74 76.43 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.708 -0.797 . . . . 0.0 109.45 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.33 -39.59 78.08 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.78 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.65 HD22 ' O ' ' A' ' 763' ' ' LEU . 1.8 tp -59.35 -38.49 80.52 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.971 -0.456 . . . . 0.0 111.2 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.11 -36.75 75.7 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 14.5 mt -67.86 -44.31 77.42 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.475 ' O ' HG13 ' A' ' 781' ' ' ILE . 6.0 pt -58.1 -36.5 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.409 HG22 HD11 ' B' ' 746' ' ' ILE . 91.7 t -53.54 -44.53 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 O-C-N 121.911 -0.493 . . . . 0.0 109.904 -177.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 51.7 p -63.79 -36.8 85.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.117 0.96 . . . . 0.0 109.649 177.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -34.11 76.55 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.832 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 777' ' ' ILE . 55.8 mt -68.76 -42.73 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.664 -0.647 . . . . 0.0 110.86 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.29 -38.55 82.43 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 O-C-N 121.467 -0.77 . . . . 0.0 110.343 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -42.86 91.98 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.713 0.768 . . . . 0.0 109.378 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.69 -37.06 85.42 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.496 0.665 . . . . 0.0 109.821 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.292 0.568 . . . . 0.0 110.251 179.795 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.547 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.547 HD22 ' C ' ' B' ' 660' ' ' LEU . 1.1 mm? 55.61 102.35 0.01 OUTLIER 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.649 0.738 . . . . 0.0 110.392 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.71 176.27 2.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.546 0.689 . . . . 0.0 110.12 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.51 -42.84 61.99 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.465 0.65 . . . . 0.0 110.878 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.67 -36.69 73.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.02 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -71.2 -46.44 61.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.102 0.477 . . . . 0.0 110.864 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -67.46 -45.99 74.36 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.298 0.57 . . . . 0.0 110.89 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -20.14 66.14 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 30.8 t -67.88 -35.28 78.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.168 0.509 . . . . 0.0 110.986 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.1 mm? -59.86 -29.18 68.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.255 0.55 . . . . 0.0 111.304 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 44.7 m95 -60.3 -27.13 67.06 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 0.0 111.624 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -87.91 -10.3 51.04 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.998 -0.439 . . . . 0.0 112.18 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 10.4 m95 -74.55 -54.24 7.87 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.484 0.659 . . . . 0.0 111.015 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.15 27.77 17.28 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.286 0.565 . . . . 0.0 111.358 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -135.86 -78.69 0.42 Allowed 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.622 -0.673 . . . . 0.0 111.435 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.04 -36.87 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-O 121.64 0.733 . . . . 0.0 110.899 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -51.95 -33.18 36.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.357 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -55.96 -47.71 77.11 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.646 -0.659 . . . . 0.0 109.851 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.593 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.0 t90 -59.64 -38.13 80.56 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.879 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.523 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -58.46 -44.41 89.25 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.344 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -87.73 -42.15 12.82 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -65.76 -25.59 67.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.746 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.7 -36.64 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.774 -0.579 . . . . 0.0 110.887 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 683' ' ' ARG . . . . . 0.746 ' N ' HD12 ' B' ' 682' ' ' ILE . 4.3 ttt-85 -56.93 -47.18 81.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.165 0.507 . . . . 0.0 110.655 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.471 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.62 -34.45 65.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.553 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.82 -29.9 68.56 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.117 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.806 HD12 HG21 ' A' ' 686' ' ' ILE . 12.2 mm -60.85 -49.52 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.199 0.524 . . . . 0.0 109.995 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.26 -42.49 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 88.9 mt -58.79 -37.95 69.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 685' ' ' PHE . 56.0 t -64.75 -46.82 90.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.08 -27.0 9.58 Favored Glycine 0 CA--C 1.541 1.704 0 O-C-N 121.746 -0.596 . . . . 0.0 112.08 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.9 m -60.37 -43.55 96.44 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.557 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -32.23 70.2 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.513 -0.742 . . . . 0.0 112.361 -177.8 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.557 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.11 -44.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.589 -0.694 . . . . 0.0 109.288 -177.631 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.47 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.97 -32.74 81.15 Favored Glycine 0 CA--C 1.538 1.518 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.512 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -57.24 -37.57 72.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.522 0.677 . . . . 0.0 110.908 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 5.8 mmt180 -55.32 -28.93 56.92 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -59.36 -36.22 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 120.798 -1.189 . . . . 0.0 109.076 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.512 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -62.33 -30.36 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 O-C-N 121.691 -0.631 . . . . 0.0 110.157 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.3 m-85 -56.2 -30.32 62.12 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 121.737 -0.602 . . . . 0.0 109.5 179.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.4 -37.42 75.28 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 177.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 -39.51 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.03 -36.66 73.04 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.533 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 16.5 m -61.8 -35.38 78.02 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 122.055 -0.403 . . . . 0.0 110.917 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.42 -43.76 93.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.23 1.015 . . . . 0.0 108.361 178.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.526 HG22 HD22 ' B' ' 748' ' ' LEU . 53.3 t -64.93 -42.1 93.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.166 178.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.2 m-80 -62.19 -36.58 82.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.22 0.534 . . . . 0.0 110.856 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -68.63 -49.56 58.26 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 122.612 1.196 . . . . 0.0 110.509 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.37 -45.43 29.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -176.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -65.36 -45.94 82.16 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.437 -174.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 9.5 pt20 -105.92 -24.83 12.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.94 179.81 16.64 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -123.79 -63.84 1.19 Allowed 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.787 -0.831 . . . . 0.0 112.307 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 713' ' ' SER . . . . . 0.435 ' HA ' HG21 ' A' ' 708' ' ' VAL . 0.4 OUTLIER -63.78 159.29 54.9 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-O 118.562 -0.732 . . . . 0.0 109.738 179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -29.87 117.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.813 2.342 . . . . 0.0 112.703 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.71 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.3 tt -88.75 5.92 41.12 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 122.023 0.916 . . . . 0.0 110.139 179.762 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 122.104 0.954 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -66.03 -26.33 67.47 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.368 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -5.99 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 742' ' ' ARG . . . . . 0.539 ' HD3' HD21 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -55.08 -33.49 62.8 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.121 -0.987 . . . . 0.0 109.203 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -69.62 -34.03 73.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -47.75 70.03 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.335 178.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 745' ' ' SER . . . . . 0.477 ' O ' HD23 ' B' ' 748' ' ' LEU . 14.5 p -56.87 -34.71 68.1 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.463 HG21 ' CG2' ' A' ' 781' ' ' ILE . 0.3 OUTLIER -52.71 -23.71 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.766 178.138 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -21.63 59.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.526 HD22 HG22 ' B' ' 705' ' ' VAL . 4.0 pp -55.16 -23.52 21.9 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 121.274 0.559 . . . . 0.0 109.543 177.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 7.7 t -55.47 -53.98 30.3 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -72.64 -21.5 61.09 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.692 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.98 -20.6 34.65 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.745 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.6 -42.19 98.51 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 117.936 0.868 . . . . 0.0 109.801 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 15.7 tp -68.39 -47.31 67.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.977 0.894 . . . . 0.0 110.278 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -66.95 -34.19 77.22 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.784 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 755' ' ' LEU . . . . . 0.502 ' C ' HD13 ' B' ' 755' ' ' LEU . 2.5 tm? -58.6 -45.26 89.52 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.918 -0.489 . . . . 0.0 111.815 -176.046 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 756' ' ' ILE . . . . . 0.479 HG22 HD12 ' B' ' 760' ' ' LEU . 4.1 mp -72.08 -35.1 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.19 -30.8 69.08 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.66 ' CG ' HD22 ' C' ' 715' ' ' LEU . 10.6 m-20 -55.59 -45.4 77.42 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 120.734 -1.229 . . . . 0.0 109.271 -179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.67 -46.19 63.68 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 760' ' ' LEU . . . . . 0.479 HD12 HG22 ' B' ' 756' ' ' ILE . 44.9 mt -69.77 -46.24 66.24 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -49.97 75.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.121 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 762' ' ' SER . . . . . 0.418 ' O ' HD13 ' B' ' 774' ' ' LEU . 20.1 p -73.28 -38.33 65.96 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.635 0.731 . . . . 0.0 111.268 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.474 HD23 HD12 ' B' ' 771' ' ' LEU . 0.8 OUTLIER -65.61 -53.11 46.22 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.995 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 34.8 p -98.07 -49.13 4.87 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.516 -0.74 . . . . 0.0 112.041 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 765' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' B' ' 765' ' ' LEU . 0.3 OUTLIER 77.52 89.0 0.07 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 122.067 0.936 . . . . 0.0 111.337 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 62.62 -74.74 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.823 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 41.0 t -84.64 162.49 19.72 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.527 0.679 . . . . 0.0 111.747 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -23.18 18.01 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.631 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -67.7 -39.82 84.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 122.059 0.933 . . . . 0.0 109.004 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -58.83 -28.94 66.51 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.46 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 771' ' ' LEU . . . . . 0.474 HD12 HD23 ' B' ' 763' ' ' LEU . 2.6 tt -58.55 -30.72 67.34 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 9.3 mmt-85 -59.89 -32.88 71.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.64 -48.66 66.08 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.618 HD11 ' CZ ' ' C' ' 742' ' ' ARG . 0.4 OUTLIER -59.18 -37.8 78.27 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.3 1.048 . . . . 0.0 109.662 178.287 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -58.34 -36.37 73.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.445 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 66.1 mt -73.86 -31.71 63.31 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.615 -0.678 . . . . 0.0 112.236 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 777' ' ' ILE . . . . . 0.443 HD11 HH22 ' C' ' 742' ' ' ARG . 8.3 pt -70.35 -37.29 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.541 -0.725 . . . . 0.0 111.305 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.403 HG22 ' O ' ' B' ' 775' ' ' LEU . 35.5 m -66.08 -40.21 86.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.271 -0.893 . . . . 0.0 110.936 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.4 t -63.68 -47.41 81.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.803 -0.561 . . . . 0.0 112.081 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.7 82.1 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.699 -0.626 . . . . 0.0 111.695 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.418 HD12 ' O ' ' B' ' 777' ' ' ILE . 65.5 mt -63.97 -43.59 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 O-C-N 122.088 -0.383 . . . . 0.0 111.32 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.575 HG11 HG11 ' C' ' 749' ' ' VAL . 18.8 m -59.48 -38.24 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.48 -0.762 . . . . 0.0 109.8 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.32 -42.9 99.43 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.599 0.714 . . . . 0.0 109.674 179.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.62 -42.43 95.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.332 0.586 . . . . 0.0 110.832 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' C' ' 747' ' ' ARG . 10.9 tp -82.15 -14.58 55.47 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.041 0.448 . . . . 0.0 111.924 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -53.52 -44.2 67.45 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -75.32 141.67 43.35 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 122.296 -0.532 . . . . 0.0 109.977 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.851 -179.78 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.593 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 120.528 0.204 . . . . 0.0 110.798 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 18.4 mt 59.96 120.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.668 0.747 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -173.2 172.18 3.91 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.721 0.772 . . . . 0.0 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -57.53 -51.39 69.64 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 122.079 0.942 . . . . 0.0 109.448 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.54 ' N ' HD13 ' C' ' 663' ' ' LEU . 12.7 t70 -72.66 -16.64 61.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.759 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 tmtt? -81.08 -46.36 15.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.262 0.553 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -62.18 -46.34 89.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.241 0.543 . . . . 0.0 110.878 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.39 -22.09 66.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.982 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.7 -32.92 73.07 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.975 -0.453 . . . . 0.0 111.434 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.3 -34.16 77.5 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.194 0.521 . . . . 0.0 111.864 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.86 -26.77 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.983 0.421 . . . . 0.0 111.043 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -77.14 -31.75 55.85 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.942 0.401 . . . . 0.0 111.604 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.4 m0 -55.24 -42.65 73.71 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.542 0.687 . . . . 0.0 110.357 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 7.4 t80 55.49 34.58 23.34 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.218 0.532 . . . . 0.0 111.484 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -148.83 -73.7 0.18 Allowed 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.65 -0.656 . . . . 0.0 112.032 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.669 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -37.15 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.489 0.661 . . . . 0.0 111.599 -178.708 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -51.63 -33.54 33.8 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.91 -0.494 . . . . 0.0 111.383 -178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -57.29 -49.36 76.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.625 0.726 . . . . 0.0 109.64 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.521 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -64.56 -42.15 95.86 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.087 0.47 . . . . 0.0 110.062 179.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 32.2 mt -66.15 -35.64 81.01 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -99.56 -19.58 16.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -176.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -88.15 -18.17 29.35 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.428 -0.795 . . . . 0.0 112.281 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.522 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.0 pt -63.16 -37.58 79.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 O-C-N 121.945 -0.472 . . . . 0.0 111.786 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -57.18 -47.41 81.3 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.294 0.568 . . . . 0.0 110.044 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.494 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.0 mp -65.96 -32.17 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -61.13 -32.43 72.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.722 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 13.3 mm -61.97 -48.75 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 121.171 0.51 . . . . 0.0 110.158 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.96 -41.1 91.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 90.3 mt -59.91 -37.56 72.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.469 HG23 ' O ' ' C' ' 685' ' ' PHE . 42.6 t -54.7 -41.66 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.42 -42.07 74.0 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.91 -38.23 88.16 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.812 0.815 . . . . 0.0 109.302 177.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.37 -45.99 89.9 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.097 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.674 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -68.1 -41.09 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.662 179.804 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.541 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -32.48 78.83 Favored Glycine 0 CA--C 1.54 1.619 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.588 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.7 tt -55.0 -37.34 66.47 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.816 0.817 . . . . 0.0 110.742 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -55.49 -28.37 54.19 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.541 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.4 tt -58.36 -35.72 55.14 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.267 -0.896 . . . . 0.0 111.603 -175.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.588 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.8 p -54.26 -30.32 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 O-C-N 121.411 -0.806 . . . . 0.0 109.852 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -57.0 -31.83 65.49 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.525 -0.734 . . . . 0.0 110.52 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.22 95.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.243 1.021 . . . . 0.0 108.603 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.2 -38.74 78.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.926 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 tp -65.7 -40.04 91.88 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.183 0.593 . . . . 0.0 110.393 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -62.93 -31.99 73.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.044 0.45 . . . . 0.0 110.27 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.439 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.5 OUTLIER -63.22 -46.8 85.27 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 122.412 1.101 . . . . 0.0 108.428 177.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.514 HG13 HD13 ' C' ' 748' ' ' LEU . 84.6 t -63.12 -45.95 97.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.495 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -63.37 -36.58 84.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.128 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 15.2 ttp85 -60.24 -50.04 75.24 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 121.482 -0.761 . . . . 0.0 111.37 -176.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.522 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -77.67 -43.08 29.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -178.183 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.84 -44.73 92.31 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -175.057 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 710' ' ' GLN . . . . . 0.455 ' HB2' ' HB3' ' B' ' 758' ' ' ASP . 6.5 pt20 -103.92 -23.9 13.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.31 -177.3 16.44 Favored Glycine 0 CA--C 1.538 1.477 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -138.73 -43.66 0.48 Allowed 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.534 -0.98 . . . . 0.0 112.229 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.407 ' O ' ' C ' ' C' ' 714' ' ' PRO . 82.6 p -62.71 147.6 92.82 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 117.704 -1.141 . . . . 0.0 107.924 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 714' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' C' ' 713' ' ' SER . 44.8 Cg_exo -28.44 94.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.505 2.172 0 C-N-CA 122.962 2.442 . . . . 0.0 112.212 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.66 HD22 ' CG ' ' B' ' 758' ' ' ASP . 5.3 mp -69.84 -9.71 55.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.204 -1.362 . . . . 0.0 114.466 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 122.29 1.043 . . . . 0.0 112.386 -178.847 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 122.133 0.968 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 24.7 tpt85 -59.38 -26.99 65.58 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.898 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -34.51 70.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 111.955 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.618 ' CZ ' HD11 ' B' ' 774' ' ' LEU . 32.8 mtm105 -67.57 -27.84 67.28 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.97 -37.54 74.4 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.736 -0.603 . . . . 0.0 109.647 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.47 -43.2 67.04 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 121.502 0.668 . . . . 0.0 109.615 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -58.74 -38.12 77.7 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 121.895 -0.503 . . . . 0.0 110.914 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -56.75 -20.0 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 747' ' ' ARG . . . . . 0.417 ' HA ' HD22 ' B' ' 785' ' ' LEU . 70.8 mtp180 -59.57 -25.07 64.26 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.589 -0.694 . . . . 0.0 109.494 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.522 HD11 HG12 ' C' ' 708' ' ' VAL . 7.7 mt -55.92 -28.8 58.48 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 122.254 -0.279 . . . . 0.0 111.512 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 749' ' ' VAL . . . . . 0.575 HG11 HG11 ' B' ' 782' ' ' VAL . 85.2 t -55.43 -54.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.08 -26.91 61.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.331 1.062 . . . . 0.0 109.074 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.29 -20.9 38.15 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.054 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 47.8 m -58.74 -37.85 77.09 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.834 0.817 . . . . 0.0 109.379 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.53 -51.18 38.05 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.721 0.772 . . . . 0.0 109.994 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 754' ' ' ALA . . . . . 0.692 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.31 -34.58 78.0 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.414 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.0 tt -58.77 -45.45 89.77 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.768 -0.583 . . . . 0.0 110.785 -177.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 41.8 mm -69.88 -33.35 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 110.278 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.38 -31.14 69.35 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -55.81 -47.01 77.9 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.064 -1.022 . . . . 0.0 109.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.29 -45.36 66.47 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.991 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 27.3 mt -66.35 -45.45 80.15 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -66.43 -48.78 68.93 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.865 -0.522 . . . . 0.0 112.102 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.1 t -64.94 -45.29 86.4 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 110.759 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.449 ' O ' ' HG ' ' C' ' 774' ' ' LEU . 1.0 OUTLIER -68.34 -54.54 16.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.843 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.89 -47.48 5.54 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.124 -0.985 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 765' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' C' ' 766' ' ' PHE . 1.6 tt 72.84 129.91 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -178.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 766' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' C' ' 765' ' ' LEU . 32.9 t80 -9.05 123.53 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.902 1.281 . . . . 0.0 114.359 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 767' ' ' SER . . . . . 0.435 ' O ' ' C ' ' C' ' 768' ' ' TYR . 1.3 m 48.94 91.26 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.57 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 768' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' C' ' 770' ' ' ARG . 41.3 m-85 3.87 -97.86 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.691 1.197 . . . . 0.0 113.609 -179.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 39.59 -76.96 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.925 0.784 . . . . 0.0 113.103 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 770' ' ' ARG . . . . . 0.575 ' N ' ' O ' ' C' ' 768' ' ' TYR . 32.1 mmt180 -55.3 -29.01 57.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.465 0.706 . . . . 0.0 110.528 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.22 -38.15 79.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.671 -0.643 . . . . 0.0 109.452 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -38.82 72.94 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -69.32 -34.51 74.78 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.978 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.529 HD13 ' O ' ' C' ' 774' ' ' LEU . 3.5 tm? -58.4 -42.61 87.52 Favored 'General case' 0 C--N 1.355 0.813 0 O-C-N 121.759 -0.588 . . . . 0.0 109.606 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 8.3 mp -58.63 -43.05 89.57 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.921 -0.487 . . . . 0.0 111.181 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 9.9 mt -73.0 -33.24 65.65 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.107 0.479 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.542 ' O ' HG12 ' C' ' 781' ' ' ILE . 0.1 OUTLIER -62.35 -37.84 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.7 -42.72 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 122.151 -0.343 . . . . 0.0 110.9 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.772 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.6 p -63.36 -42.12 98.88 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.229 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -31.71 71.94 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 122.051 -0.405 . . . . 0.0 111.861 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.593 HD12 ' HB3' ' A' ' 743' ' ' ASP . 21.3 mm -56.23 -39.73 61.39 Favored 'Isoleucine or valine' 0 C--N 1.347 0.486 0 O-C-N 121.762 -0.586 . . . . 0.0 111.346 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.772 HG22 ' O ' ' C' ' 779' ' ' THR . 21.6 m -52.73 -37.44 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.464 -177.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.36 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.684 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 120.762 0.315 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 175.32 129.78 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -171.65 177.81 3.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.923 0.868 . . . . 0.0 111.117 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.488 HD23 ' N ' ' A' ' 664' ' ' ASP . 5.1 tt -51.57 -51.1 58.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.721 0.772 . . . . 0.0 110.544 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 664' ' ' ASP . . . . . 0.488 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.3 t70 -64.9 -30.51 71.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.864 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -48.15 37.22 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.406 0.622 . . . . 0.0 110.815 -179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -62.81 -46.08 89.62 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.674 0.75 . . . . 0.0 110.33 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.77 -20.2 65.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.718 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 24.7 t -71.38 -32.07 68.04 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.156 0.503 . . . . 0.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.99 -34.62 73.57 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.897 0.379 . . . . 0.0 111.061 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -59.69 -16.44 26.75 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.842 -0.536 . . . . 0.0 111.313 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -82.63 -26.16 32.48 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.361 0.6 . . . . 0.0 110.732 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -60.31 -42.07 94.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.537 0.684 . . . . 0.0 110.299 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.5 t80 60.56 35.09 20.16 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.543 0.687 . . . . 0.0 111.267 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -156.09 -66.92 0.11 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.619 -0.675 . . . . 0.0 111.652 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -65.55 -37.37 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 O-C-N 121.891 -0.506 . . . . 0.0 111.342 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.48 -34.3 48.55 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.898 -0.501 . . . . 0.0 111.986 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -63.4 -50.53 69.47 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.326 0.584 . . . . 0.0 110.261 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.581 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.5 t90 -66.01 -44.12 85.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 122.167 0.984 . . . . 0.0 109.53 178.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -35.77 77.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.949 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -101.25 -50.53 3.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -59.9 -10.35 3.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.545 -0.722 . . . . 0.0 112.645 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.766 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.0 pp -60.71 -36.33 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 121.657 -0.652 . . . . 0.0 110.368 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.766 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.9 ttt-85 -54.63 -47.27 73.68 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.998 0.427 . . . . 0.0 110.403 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -69.38 -35.99 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.3 OUTLIER -59.96 -30.51 69.15 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.122 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.99 HD12 HG21 ' C' ' 686' ' ' ILE . 12.3 mm -60.58 -50.04 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.374 0.607 . . . . 0.0 109.629 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 79.2 mt -60.84 -39.02 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.1 -36.97 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.049 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.7 t -54.17 -40.04 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.237 -0.914 . . . . 0.0 108.554 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.43 -39.2 92.59 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -64.72 -38.21 90.22 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.666 0.746 . . . . 0.0 109.587 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -46.18 89.05 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.502 -178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -40.29 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.257 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.63 -28.42 67.8 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -61.98 -37.54 85.16 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.488 1.137 . . . . 0.0 109.035 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 29.7 mmt180 -55.73 -27.64 51.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.054 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 mm -58.19 -36.29 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 121.108 -0.995 . . . . 0.0 108.681 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.759 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -61.95 -30.29 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 O-C-N 121.534 -0.729 . . . . 0.0 110.572 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 6.4 m-85 -55.38 -29.07 57.76 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.865 -0.522 . . . . 0.0 110.54 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.14 -36.97 71.34 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.759 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.7 m -59.36 -36.2 62.62 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 CA-C-O 121.727 0.775 . . . . 0.0 108.967 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -60.89 -38.92 87.34 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.823 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 54.7 m -63.07 -38.86 92.89 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.762 0.792 . . . . 0.0 109.695 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.632 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.5 OUTLIER -61.4 -40.87 95.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 122.179 0.99 . . . . 0.0 109.312 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.798 HG22 HD12 ' A' ' 748' ' ' LEU . 95.8 t -68.56 -43.59 83.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.065 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -62.31 -41.79 98.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.409 ' HA ' HD21 ' C' ' 704' ' ' LEU . 15.1 ptp180 -66.05 -38.74 89.11 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 121.012 -1.055 . . . . 0.0 111.498 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.35 -43.96 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.955 0.883 . . . . 0.0 108.893 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -73.77 -15.73 61.19 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -87.97 -20.87 25.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.279 -0.888 . . . . 0.0 111.992 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.94 37.99 2.09 Favored Glycine 0 CA--C 1.54 1.638 0 O-C-N 121.6 -0.687 . . . . 0.0 113.094 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' NH1' ' C' ' 707' ' ' ARG . 0.6 OUTLIER 49.17 -133.49 1.5 Allowed 'General case' 0 CA--C 1.566 1.576 0 O-C-N 121.616 -0.932 . . . . 0.0 110.077 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.569 ' HA ' HG21 ' C' ' 708' ' ' VAL . 6.7 p -62.92 159.9 42.17 Favored Pre-proline 0 C--N 1.354 0.784 0 O-C-N 120.925 -1.11 . . . . 0.0 109.138 178.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 714' ' ' PRO . . . . . 0.421 ' HG3' HD12 ' C' ' 748' ' ' LEU . 35.7 Cg_exo -36.81 119.76 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.144 1.896 . . . . 0.0 112.877 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.449 HD23 ' N ' ' A' ' 716' ' ' SER . 0.1 OUTLIER -109.35 -20.54 12.89 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.449 ' N ' HD23 ' A' ' 715' ' ' LEU . 1.4 t . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 122.482 1.134 . . . . 0.0 110.589 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 CA--C 1.536 0.437 0 CA-C-O 121.698 0.761 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -58.04 -26.56 62.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.385 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.27 -37.01 74.13 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.695 -0.628 . . . . 0.0 112.133 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 742' ' ' ARG . . . . . 0.506 ' HD3' ' HB2' ' C' ' 762' ' ' SER . 0.1 OUTLIER -59.2 -46.39 88.54 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.777 -0.577 . . . . 0.0 112.363 -179.051 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 743' ' ' ASP . . . . . 0.791 ' HA ' HD11 ' C' ' 781' ' ' ILE . 1.4 p30 -59.46 -44.77 92.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.577 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.84 71.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.931 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 9.2 p -59.82 -42.52 93.68 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 122.113 -0.367 . . . . 0.0 111.438 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.878 HG22 HG21 ' C' ' 781' ' ' ILE . 21.9 mt -65.63 -46.64 88.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-O 116.771 -1.585 . . . . 0.0 113.66 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.489 ' HD2' ' HA ' ' C' ' 782' ' ' VAL . 0.1 OUTLIER -67.59 -5.0 13.42 Favored 'General case' 0 C--N 1.351 0.663 0 CA-C-N 122.204 2.275 . . . . 0.0 109.989 -178.862 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.798 HD12 HG22 ' A' ' 705' ' ' VAL . 2.8 tm? -54.9 -15.13 1.76 Allowed 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.452 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.304 1.3 t -53.1 -53.95 19.77 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 175.087 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -72.39 -30.22 64.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 113.999 -1.455 . . . . 0.0 107.727 174.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.499 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.36 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 96.0 p -57.28 -36.87 71.57 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.3 -49.21 77.93 Favored 'General case' 0 C--N 1.346 0.457 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 176.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.0 73.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.735 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -59.21 -42.58 91.28 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.857 -0.527 . . . . 0.0 111.239 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 66.1 mt -61.61 -35.68 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.96 -30.61 69.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.199 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.511 ' HB3' HD13 ' B' ' 715' ' ' LEU . 7.1 m-20 -55.7 -49.22 73.59 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.566 -0.709 . . . . 0.0 109.58 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.75 -43.73 68.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.873 0.844 . . . . 0.0 110.388 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 760' ' ' LEU . . . . . 0.4 ' HA ' HD11 ' A' ' 763' ' ' LEU . 0.3 OUTLIER -59.74 -32.39 70.51 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.924 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -82.27 -31.14 30.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -177.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 35.8 t -66.46 -46.61 75.81 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.397 -0.814 . . . . 0.0 112.766 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -69.37 -55.05 11.52 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 121.661 -0.649 . . . . 0.0 112.406 -179.589 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 4.5 p -98.26 -49.13 4.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.685 0.755 . . . . 0.0 112.959 -177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.483 HD12 ' HG2' ' B' ' 739' ' ' GLU . 0.6 OUTLIER 83.76 -70.26 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.663 0.785 . . . . 0.0 110.636 -177.91 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -128.72 -58.25 1.17 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.792 -0.568 . . . . 0.0 111.051 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.4 m -92.2 132.15 36.87 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.081 0.467 . . . . 0.0 110.126 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CZ ' HD22 ' A' ' 771' ' ' LEU . 1.7 t80 -61.77 -13.0 19.67 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.121 -0.362 . . . . 0.0 111.413 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -37.56 87.99 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.926 0.87 . . . . 0.0 108.995 178.032 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -29.27 59.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.578 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 763' ' ' LEU . 24.4 tp -58.97 -39.44 81.73 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 41.5 mtp180 -66.93 -32.96 74.56 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.54 -45.68 74.99 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.679 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' HG23 ' A' ' 778' ' ' VAL . 5.7 tp -58.97 -42.29 89.58 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.136 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 775' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 775' ' ' LEU . 1.1 tt -63.38 -38.53 91.51 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.689 -0.632 . . . . 0.0 111.005 -177.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.75 -43.96 57.57 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 121.944 -0.473 . . . . 0.0 112.013 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 777' ' ' ILE . . . . . 0.415 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.6 pp -68.68 -37.45 77.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.048 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 774' ' ' LEU . 41.1 t -56.29 -46.17 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 121.791 -0.568 . . . . 0.0 109.706 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 779' ' ' THR . . . . . 0.738 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.8 p -63.52 -46.01 88.01 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.835 -0.541 . . . . 0.0 112.067 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -31.79 72.37 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.471 ' HB ' HG21 ' B' ' 746' ' ' ILE . 56.4 mt -54.77 -36.41 36.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.583 -0.698 . . . . 0.0 110.55 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 779' ' ' THR . 13.1 m -54.2 -38.39 38.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 121.23 -0.919 . . . . 0.0 109.753 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.34 -49.22 78.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.626 0.726 . . . . 0.0 110.774 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 31.3 tp -70.01 -42.48 72.94 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.264 0.554 . . . . 0.0 111.92 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.513 HD11 ' HG3' ' B' ' 747' ' ' ARG . 0.2 OUTLIER . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 121.021 0.439 . . . . 0.0 111.703 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.452 ' C ' HD22 ' B' ' 661' ' ' LEU . 4.0 mp . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.57 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.0 mm? 61.77 115.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.524 0.678 . . . . 0.0 110.327 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -179.72 170.99 1.23 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.467 HD11 ' HB2' ' C' ' 660' ' ' LEU . 32.8 tp -64.22 -40.75 96.7 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 121.473 0.654 . . . . 0.0 110.498 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.13 -24.15 67.76 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.379 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -81.26 -43.21 19.53 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -62.02 -46.79 87.64 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 122.006 0.908 . . . . 0.0 110.607 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.22 65.45 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.618 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 7.1 t -72.31 -29.22 63.65 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.819 0.342 . . . . 0.0 111.389 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.562 HD12 HG23 ' B' ' 675' ' ' ILE . 3.8 mm? -59.91 -32.73 71.03 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 122.185 -0.322 . . . . 0.0 111.179 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -59.66 -20.38 55.76 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.769 -0.582 . . . . 0.0 111.197 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -88.0 -20.41 25.87 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.169 0.509 . . . . 0.0 111.341 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -72.55 -46.7 53.18 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.099 0.476 . . . . 0.0 111.127 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 67.7 t80 58.66 19.86 7.19 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.379 0.609 . . . . 0.0 111.314 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -130.53 -67.72 0.72 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 121.378 -0.826 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.562 HG23 HD12 ' B' ' 669' ' ' LEU . 6.4 tp -68.27 -37.11 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.891 0.377 . . . . 0.0 110.92 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.15 -33.92 42.42 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.232 -0.293 . . . . 0.0 111.775 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -63.79 -50.35 69.35 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 109.883 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.652 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.97 -43.08 88.94 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 121.751 0.786 . . . . 0.0 109.754 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -35.75 82.1 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 8.9 t90 -103.93 -26.68 12.56 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -82.24 -10.48 59.11 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.513 -0.742 . . . . 0.0 111.761 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.652 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -60.85 -36.33 70.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.824 -0.548 . . . . 0.0 110.793 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.5 ttt-85 -53.32 -47.39 69.33 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.925 0.393 . . . . 0.0 110.4 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.461 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -66.7 -35.58 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.528 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.03 -29.46 68.52 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.18 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.696 HD12 HG21 ' A' ' 686' ' ' ILE . 17.6 mm -60.79 -48.28 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.211 0.529 . . . . 0.0 110.277 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.44 -43.17 94.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 89.4 mt -58.85 -37.71 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 685' ' ' PHE . 46.6 t -62.2 -48.77 86.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.5 -27.1 11.12 Favored Glycine 0 CA--C 1.54 1.613 0 O-C-N 121.772 -0.58 . . . . 0.0 111.896 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.0 m -60.61 -39.68 89.07 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.494 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.62 -32.7 70.66 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.235 -0.916 . . . . 0.0 111.643 -177.619 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.494 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.87 -46.96 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.883 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.45 -27.39 67.78 Favored Glycine 0 CA--C 1.542 1.737 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 178.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -37.16 67.37 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.758 0.789 . . . . 0.0 110.458 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 15.9 mmt180 -55.18 -27.99 49.78 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.726 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.29 -36.44 58.1 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 O-C-N 120.792 -1.193 . . . . 0.0 109.465 -177.074 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.0 p -66.99 -30.25 48.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.477 -0.764 . . . . 0.0 110.169 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.6 m-85 -55.88 -30.58 61.77 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.648 -0.657 . . . . 0.0 109.652 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.57 76.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -41.98 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 176.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.08 -37.87 72.51 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.445 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 29.2 m -62.83 -37.0 85.04 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.289 0.566 . . . . 0.0 110.38 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -45.26 93.29 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 122.322 1.058 . . . . 0.0 109.137 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.8 -43.34 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.995 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.36 -36.42 82.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.568 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -63.58 -49.56 72.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 122.404 1.097 . . . . 0.0 110.764 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD21 ' B' ' 748' ' ' LEU . 1.5 t -77.16 -44.9 30.81 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 114.79 -1.095 . . . . 0.0 113.645 -177.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.25 -45.94 92.43 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.639 ' O ' HD12 ' B' ' 715' ' ' LEU . 5.1 pt20 -105.77 -24.69 12.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.415 1.102 . . . . 0.0 113.644 178.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 129.63 136.34 4.05 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 712' ' ' TYR . . . . . 0.632 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.8 p90 -73.71 -61.77 1.72 Allowed 'General case' 0 N--CA 1.477 0.913 0 O-C-N 122.002 -0.705 . . . . 0.0 112.072 -178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 54.9 p -66.35 159.36 73.0 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.632 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.51 ' HB3' HD23 ' A' ' 748' ' ' LEU . 41.7 Cg_exo -32.5 131.78 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.31 2.007 . . . . 0.0 112.825 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.639 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.6 tt -93.74 -20.42 20.15 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -176.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 716' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 715' ' ' LEU . 2.8 t . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 122.17 0.986 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 739' ' ' GLU . . . . . 0.483 ' HG2' HD12 ' A' ' 765' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 18.4 tpt85 -65.94 -26.98 67.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.575 0.703 . . . . 0.0 111.275 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -60.83 -6.7 1.9 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -55.73 -39.63 71.39 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.517 -0.739 . . . . 0.0 111.195 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -58.02 -39.69 78.97 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.655 -0.653 . . . . 0.0 109.74 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -68.01 -38.85 83.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 745' ' ' SER . . . . . 0.458 ' O ' HD23 ' B' ' 748' ' ' LEU . 1.3 p -59.7 -44.68 93.57 Favored 'General case' 0 N--CA 1.462 0.175 0 O-C-N 121.963 -0.461 . . . . 0.0 110.564 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.51 HD11 HG22 ' A' ' 778' ' ' VAL . 1.2 mp -55.17 -19.45 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.418 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.513 ' HG3' HD11 ' A' ' 785' ' ' LEU . 1.3 ttt85 -59.89 -26.63 66.04 Favored 'General case' 0 C--N 1.346 0.428 0 O-C-N 121.594 -0.691 . . . . 0.0 109.437 178.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.664 HD21 HG11 ' B' ' 708' ' ' VAL . 3.2 mm? -55.49 -20.4 12.7 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 749' ' ' VAL . . . . . 0.414 HG23 ' O ' ' B' ' 746' ' ' ILE . 65.2 t -57.43 -54.22 33.84 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 176.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -72.94 -18.0 61.43 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.211 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.06 -20.68 35.56 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.915 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 23.1 p -58.76 -38.05 77.6 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.031 0.916 . . . . 0.0 109.685 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.91 -49.98 58.83 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.243 0.544 . . . . 0.0 110.029 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.52 78.61 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.98 -45.53 88.64 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.582 -0.699 . . . . 0.0 111.604 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 55.9 mt -67.01 -38.59 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 121.835 0.826 . . . . 0.0 109.484 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.01 67.96 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.587 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -55.15 -49.35 72.03 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.734 -1.229 . . . . 0.0 110.05 -178.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.25 -46.36 61.18 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.18 -46.83 63.81 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -63.85 -37.82 88.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.37 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 84.5 p -70.44 -45.17 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.52 0.676 . . . . 0.0 110.957 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.678 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.7 OUTLIER -61.92 -53.7 52.13 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.926 0.714 . . . . 0.0 112.926 -178.517 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.6 p -98.5 -11.82 21.89 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -177.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.41 -154.62 0.34 Allowed 'General case' 0 CA--C 1.552 1.023 0 O-C-N 121.206 -0.934 . . . . 0.0 108.54 -177.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -48.93 -72.61 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.36 -0.837 . . . . 0.0 111.529 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 87.6 p -80.34 177.2 9.13 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.707 -0.621 . . . . 0.0 111.334 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.42 -31.98 13.13 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.978 -0.451 . . . . 0.0 110.722 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -53.89 -35.18 61.32 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.522 0.677 . . . . 0.0 109.854 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -29.57 60.33 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.66 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -59.44 -35.45 74.04 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 121.934 -0.479 . . . . 0.0 110.103 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -39.24 90.63 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -69.18 -45.18 70.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.337 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.678 HD13 ' O ' ' B' ' 763' ' ' LEU . 1.0 OUTLIER -63.05 -37.9 89.04 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.958 0.885 . . . . 0.0 110.564 179.721 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.537 HD13 ' O ' ' B' ' 775' ' ' LEU . 3.5 tm? -58.75 -36.66 74.72 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.381 0.61 . . . . 0.0 110.539 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.27 -35.61 73.86 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.59 -0.694 . . . . 0.0 112.152 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 21.7 pt -70.29 -37.09 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 O-C-N 121.688 -0.632 . . . . 0.0 111.325 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.513 HG12 HG12 ' C' ' 746' ' ' ILE . 3.4 m -61.9 -39.48 83.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 121.132 -0.98 . . . . 0.0 109.857 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 20.4 p -63.69 -47.32 81.66 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.929 -0.482 . . . . 0.0 112.2 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -33.25 74.15 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.405 -0.809 . . . . 0.0 111.269 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 71.0 mt -66.12 -44.57 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.8 -0.563 . . . . 0.0 111.834 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.603 HG11 HG11 ' C' ' 749' ' ' VAL . 24.8 m -59.3 -38.1 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.471 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -57.41 -44.25 84.43 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.798 0.809 . . . . 0.0 109.82 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 25.6 tp -69.98 -43.46 71.44 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.871 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' C' ' 750' ' ' ASN . 8.2 tp -65.03 -25.23 67.75 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.964 -0.46 . . . . 0.0 111.15 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -36.17 -47.96 1.1 Allowed Glycine 0 CA--C 1.536 1.363 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.75 97.44 8.08 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.686 -179.076 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.5 ' O ' HD12 ' C' ' 660' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 121.576 0.703 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.32 160.28 15.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.093 0.473 . . . . 0.0 110.818 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 172.81 175.56 0.1 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.29 0.567 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.699 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -58.07 -45.95 86.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.85 0.834 . . . . 0.0 109.622 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.654 ' N ' HD13 ' C' ' 663' ' ' LEU . 10.0 t70 -73.3 -22.7 60.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.149 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -46.51 14.58 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.1 0.476 . . . . 0.0 111.145 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -58.8 -46.15 88.26 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.406 0.622 . . . . 0.0 109.602 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.75 -21.04 65.29 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.971 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.1 t -64.86 -35.12 80.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.987 0.423 . . . . 0.0 111.523 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.68 -36.28 76.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.132 0.491 . . . . 0.0 110.98 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -59.55 -22.15 61.29 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.3 0.571 . . . . 0.0 110.768 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -75.93 -29.26 58.29 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.457 0.646 . . . . 0.0 110.736 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -61.52 -41.66 97.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.749 0.785 . . . . 0.0 109.892 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 5.7 t80 58.87 36.03 24.46 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.027 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -160.98 -68.08 0.06 Allowed 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.571 -0.706 . . . . 0.0 112.291 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.635 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -62.91 -37.22 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-O 121.472 0.653 . . . . 0.0 111.415 -178.689 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -52.41 -33.67 44.81 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 122.014 -0.429 . . . . 0.0 111.444 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -56.83 -49.25 75.98 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.63 0.729 . . . . 0.0 109.745 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.559 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.2 t90 -65.14 -40.62 94.67 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.908 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.69 -35.89 82.07 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -92.86 -48.39 6.57 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -60.34 -21.16 61.74 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.902 -0.499 . . . . 0.0 112.086 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.1 pp -60.48 -36.5 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 O-C-N 121.713 -0.617 . . . . 0.0 110.547 179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -57.65 -47.14 83.09 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.244 0.545 . . . . 0.0 110.257 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.471 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -70.95 -33.25 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 121.67 0.747 . . . . 0.0 109.067 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.452 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.62 -33.99 72.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.037 -179.309 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.99 HG21 HD12 ' A' ' 686' ' ' ILE . 13.0 mm -60.65 -43.48 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.45 0.643 . . . . 0.0 109.498 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -66.01 -41.65 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.25 -38.0 72.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.452 HG23 ' O ' ' C' ' 685' ' ' PHE . 69.3 t -54.99 -40.42 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.08 -37.82 87.27 Favored Glycine 0 CA--C 1.531 1.058 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -67.29 -37.72 83.86 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.063 0.935 . . . . 0.0 109.465 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.24 -44.55 92.35 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.024 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -62.68 -42.05 94.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 121.242 0.544 . . . . 0.0 109.778 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.62 -33.08 80.65 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.507 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.8 tt -60.82 -37.93 83.68 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.971 0.891 . . . . 0.0 109.839 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -56.09 -28.3 57.14 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.6 tt -58.44 -36.02 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.258 -0.901 . . . . 0.0 111.206 -175.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.507 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.5 p -54.43 -30.18 21.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 121.425 -0.797 . . . . 0.0 110.219 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -56.39 -31.3 63.72 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.822 -0.549 . . . . 0.0 110.293 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.65 82.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -68.72 -42.52 83.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.82 -38.14 84.4 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.496 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.0 m -66.76 -37.12 83.99 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.424 0.631 . . . . 0.0 110.088 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -63.73 -42.32 97.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.954 0.883 . . . . 0.0 108.821 178.444 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.659 HG13 HD21 ' C' ' 748' ' ' LEU . 41.0 t -65.08 -45.54 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 122.546 1.165 . . . . 0.0 108.716 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.85 -35.89 81.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.015 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.412 ' NH1' ' CZ ' ' A' ' 712' ' ' TYR . 0.0 OUTLIER -62.56 -49.58 74.72 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 121.685 -0.635 . . . . 0.0 111.336 -177.11 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.569 HG21 ' HA ' ' A' ' 713' ' ' SER . 3.0 p -77.47 -44.41 29.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.527 0.68 . . . . 0.0 112.331 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 709' ' ' ARG . . . . . 0.455 ' HB2' HD22 ' C' ' 748' ' ' LEU . 2.3 tmm_? -73.97 -33.11 63.74 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -101.56 -17.68 16.27 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 113.048 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.84 169.87 14.91 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -120.96 -48.56 2.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.217 -0.578 . . . . 0.0 110.962 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 25.7 p -106.69 157.98 33.86 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.615 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 714' ' ' PRO . . . . . 0.402 ' HG3' HD22 ' B' ' 748' ' ' LEU . 51.1 Cg_exo -38.14 96.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.803 0 C-N-CA 121.913 1.742 . . . . 0.0 111.912 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' C' ' 716' ' ' SER . 28.1 tp -73.41 -20.68 60.67 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.001 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 716' ' ' SER . . . . . 0.469 ' C ' ' O ' ' C' ' 715' ' ' LEU . 3.2 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.079 0.943 . . . . 0.0 113.04 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.908 0.861 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 tpt85 -71.86 -26.85 62.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.563 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -38.92 84.91 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.24 0.543 . . . . 0.0 110.803 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.774 ' O ' HD12 ' C' ' 746' ' ' ILE . 28.0 mtm105 -62.5 -36.39 82.39 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.102 -0.374 . . . . 0.0 111.319 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -58.46 -39.93 81.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.484 . . . . 0.0 110.102 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.59 -49.33 41.49 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.137 0.494 . . . . 0.0 110.798 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -33.83 67.04 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.012 -0.43 . . . . 0.0 110.699 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.774 HD12 ' O ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -59.23 -24.43 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 O-C-N 121.469 -0.769 . . . . 0.0 109.095 178.264 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -59.37 -21.49 59.94 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.659 HD21 HG13 ' C' ' 705' ' ' VAL . 9.3 tp -55.62 -27.21 48.31 Favored 'General case' 0 C--N 1.348 0.519 0 O-C-N 122.128 -0.358 . . . . 0.0 110.748 178.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 749' ' ' VAL . . . . . 0.603 HG11 HG11 ' B' ' 782' ' ' VAL . 90.0 t -55.52 -54.08 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.443 ' HB2' HD23 ' B' ' 785' ' ' LEU . 7.9 m120 -72.42 -25.8 61.62 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.33 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.59 -20.96 40.67 Favored Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.705 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.0 m -59.98 -37.95 81.11 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.752 -0.852 . . . . 0.0 109.386 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.6 tp -66.7 -51.2 58.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.418 0.628 . . . . 0.0 109.889 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.0 79.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.584 0.707 . . . . 0.0 111.365 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 755' ' ' LEU . . . . . 0.52 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.1 tt -59.4 -45.45 91.46 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 -178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.25 -35.04 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.64 0.733 . . . . 0.0 109.325 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.14 68.1 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.471 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -55.36 -46.61 76.46 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.069 -1.019 . . . . 0.0 109.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.69 -45.48 64.93 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.15 -44.0 73.19 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 761' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' C' ' 765' ' ' LEU . 10.3 mtm180 -61.39 -49.8 75.46 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 762' ' ' SER . . . . . 0.506 ' HB2' ' HD3' ' A' ' 742' ' ' ARG . 1.7 p -66.15 -45.31 81.41 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.542 -0.724 . . . . 0.0 110.8 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.516 ' HA ' ' HG ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -59.72 -54.38 47.08 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 -178.408 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.86 -48.72 4.81 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 765' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' C' ' 761' ' ' ARG . 0.3 OUTLIER 85.97 -78.61 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -177.642 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -124.59 -86.89 0.63 Allowed 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.483 -0.761 . . . . 0.0 111.337 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 83.4 p -90.13 167.28 12.85 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.56 -0.713 . . . . 0.0 110.225 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.12 -16.18 63.6 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.949 0.404 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -71.12 -44.03 66.42 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -62.69 -30.65 71.55 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.335 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.431 ' C ' HD23 ' C' ' 771' ' ' LEU . 5.3 tt -60.54 -30.49 69.79 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.828 -0.545 . . . . 0.0 109.86 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -57.25 -38.44 73.83 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.167 -0.333 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.29 -39.2 93.9 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.739 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.722 HD22 HD12 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -67.39 -38.17 84.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 121.772 0.796 . . . . 0.0 109.872 178.498 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.724 ' O ' HG22 ' C' ' 778' ' ' VAL . 2.7 mm? -58.42 -36.27 73.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.81 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -70.56 -29.68 66.2 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.536 -0.727 . . . . 0.0 110.405 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 777' ' ' ILE . . . . . 0.722 HD12 HD22 ' C' ' 774' ' ' LEU . 48.2 mt -60.77 -39.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.346 0.415 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.153 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.724 HG22 ' O ' ' C' ' 775' ' ' LEU . 15.0 m -55.5 -43.83 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 119.067 0.849 . . . . 0.0 113.013 -175.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.534 ' O ' HG22 ' C' ' 782' ' ' VAL . 2.4 p -64.28 -48.21 76.56 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.107 -0.995 . . . . 0.0 111.615 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -29.13 68.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.878 HG21 HG22 ' A' ' 746' ' ' ILE . 0.1 OUTLIER -52.98 -36.55 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.6 -175.534 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.534 HG22 ' O ' ' C' ' 779' ' ' THR . 34.5 m -53.41 -37.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 119.11 -1.036 . . . . 0.0 112.092 -177.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.675 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.732 ' N ' HD23 ' C' ' 663' ' ' LEU . 6.8 tp . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 48.2 mt 56.82 90.08 0.04 OUTLIER 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.994 0.902 . . . . 0.0 110.267 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -161.7 -177.34 5.82 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.519 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.486 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.5 OUTLIER -52.31 -40.68 62.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.201 0.525 . . . . 0.0 110.512 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -36.02 65.92 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -178.476 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -43.54 56.95 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.387 0.613 . . . . 0.0 111.075 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -74.0 -45.83 47.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.406 -179.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.52 -35.86 82.13 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.137 0.494 . . . . 0.0 111.337 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -32.79 68.48 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.319 0.58 . . . . 0.0 110.886 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -24.1 67.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.828 0.347 . . . . 0.0 111.487 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -67.95 -19.57 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.003 -0.436 . . . . 0.0 111.688 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -80.88 -17.81 49.36 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.046 0.45 . . . . 0.0 111.508 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.72 -47.98 82.8 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.2 48.01 3.87 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 112.181 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.81 -71.48 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.651 -0.655 . . . . 0.0 112.235 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.657 HG13 HD23 ' A' ' 679' ' ' LEU . 7.2 tp -66.83 -36.81 78.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 O-C-N 121.804 -0.56 . . . . 0.0 112.054 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.7 m -51.75 -33.21 33.97 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.922 -0.486 . . . . 0.0 112.037 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.38 -49.55 77.37 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.564 -0.71 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -65.78 -44.8 84.7 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.545 0.688 . . . . 0.0 110.583 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.657 HD23 HG13 ' A' ' 675' ' ' ILE . 4.5 mm? -66.64 -37.43 84.81 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -89.91 -1.93 58.08 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -119.96 0.18 10.74 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.431 0.634 . . . . 0.0 110.619 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 685' ' ' PHE . 2.4 tp -61.66 -36.36 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-O 122.115 0.96 . . . . 0.0 110.112 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -59.39 -44.89 92.72 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.78 -33.66 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -59.66 -33.48 71.6 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.804 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.995 HG21 HD12 ' B' ' 686' ' ' ILE . 8.4 mm -60.69 -42.42 91.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.166 0.508 . . . . 0.0 109.9 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -71.82 -39.56 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.4 mt -61.94 -40.69 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.971 -0.455 . . . . 0.0 110.6 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 685' ' ' PHE . 63.0 t -54.49 -39.46 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.14 -36.54 82.56 Favored Glycine 0 CA--C 1.537 1.456 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.8 m -65.02 -38.16 89.99 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.816 0.817 . . . . 0.0 109.455 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.05 -46.39 88.36 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.704 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.787 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -68.48 -39.89 81.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.596 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.92 -20.74 54.1 Favored Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.219 -0.925 . . . . 0.0 111.014 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -36.68 82.47 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 122.128 0.965 . . . . 0.0 110.151 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 24.9 mmt180 -56.3 -30.18 62.18 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 1.4 pp -60.5 -36.64 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.542 -1.349 . . . . 0.0 108.893 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.81 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.3 t -67.16 -30.24 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 CA-C-N 115.357 -0.838 . . . . 0.0 108.933 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.2 OUTLIER -55.64 -27.92 52.45 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 122.871 0.468 . . . . 0.0 110.343 178.6 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.44 -36.97 69.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.81 HG22 ' O ' ' A' ' 698' ' ' VAL . 11.4 m -59.1 -35.69 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -42.6 91.35 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 703' ' ' SER . . . . . 0.434 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 7.2 m -66.13 -41.16 90.87 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.795 0.807 . . . . 0.0 109.734 179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -40.84 94.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.788 HG23 HD12 ' A' ' 748' ' ' LEU . 0.4 OUTLIER -69.26 -39.61 79.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.448 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 706' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 710' ' ' GLN . 1.7 m120 -62.3 -36.93 83.64 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.102 0.561 . . . . 0.0 111.493 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 9.0 ttm180 -62.59 -49.47 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.703 0.763 . . . . 0.0 110.252 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.04 -42.09 31.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.823 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -58.69 -41.37 86.09 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -174.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 710' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 706' ' ' ASN . 4.9 pt20 -101.97 -21.87 14.41 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -176.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 164.82 -128.11 1.74 Allowed Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.681 -0.637 . . . . 0.0 112.459 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 712' ' ' TYR . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 707' ' ' ARG . 0.1 OUTLIER -171.85 -116.84 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -178.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 713' ' ' SER . . . . . 0.436 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 7.3 m -62.83 159.4 45.36 Favored Pre-proline 0 C--N 1.352 0.687 0 O-C-N 120.641 -1.287 . . . . 0.0 109.083 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_exo -42.88 101.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.358 1.372 . . . . 0.0 111.699 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 715' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 716' ' ' SER . 0.2 OUTLIER -104.39 -20.79 13.62 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.362 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 716' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 121.997 0.903 . . . . 0.0 111.671 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.98 0.895 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -26.43 62.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.13 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.5 -9.94 0.57 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.8 mtm-85 -64.95 -46.36 81.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.349 -0.845 . . . . 0.0 111.208 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -63.44 -44.69 93.79 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.486 0.66 . . . . 0.0 111.685 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -71.19 -36.86 72.08 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.711 -0.618 . . . . 0.0 110.56 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 89.9 p -64.47 -42.21 96.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.759 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 746' ' ' ILE . . . . . 0.558 HD13 ' CD1' ' C' ' 781' ' ' ILE . 0.8 OUTLIER -64.96 -46.95 90.08 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.872 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.188 -178.744 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 747' ' ' ARG . . . . . 0.442 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.32 14.3 ttt180 -70.26 -0.02 7.23 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 116.153 -2.219 . . . . 0.0 111.699 -176.844 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 748' ' ' LEU . . . . . 0.788 HD12 HG23 ' A' ' 705' ' ' VAL . 2.8 tm? -57.22 -15.5 6.03 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 169.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 749' ' ' VAL . . . . . 0.43 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.308 1.6 t -52.96 -54.37 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.719 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -72.86 -26.19 61.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 122.611 1.196 . . . . 0.0 108.458 174.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 751' ' ' GLY . . . . . 0.672 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.64 -19.27 27.05 Favored Glycine 0 C--N 1.341 0.831 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.822 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 11.1 p -57.23 -37.29 72.06 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.65 -47.69 84.22 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.12 -35.36 78.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.963 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 755' ' ' LEU . . . . . 0.696 ' O ' HD22 ' A' ' 755' ' ' LEU . 0.6 OUTLIER -59.26 -45.07 92.18 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.668 -0.645 . . . . 0.0 110.908 -177.92 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.7 mt -61.65 -37.75 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.62 -33.87 73.27 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.087 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 758' ' ' ASP . . . . . 0.814 ' OD1' HD22 ' B' ' 715' ' ' LEU . 17.7 m-20 -55.98 -45.11 79.06 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.823 0.82 . . . . 0.0 109.715 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.11 -41.38 74.06 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.432 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.23 -33.94 76.4 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 28.1 mtt85 -73.65 -25.8 60.45 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 60.5 p -77.02 -45.52 26.94 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.624 -0.673 . . . . 0.0 111.217 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 763' ' ' LEU . . . . . 0.695 ' HA ' HD13 ' A' ' 774' ' ' LEU . 10.4 mp -68.39 -54.94 13.84 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.01 -49.3 4.56 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.547 0.689 . . . . 0.0 112.493 -178.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 765' ' ' LEU . . . . . 0.457 HD23 ' CD ' ' B' ' 739' ' ' GLU . 1.1 tm? 88.62 -72.56 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.184 0.993 . . . . 0.0 109.658 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -118.67 -67.09 1.01 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.773 -0.58 . . . . 0.0 111.157 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.81 148.15 24.73 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.32 0.581 . . . . 0.0 110.842 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -62.62 -23.62 67.15 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.993 0.425 . . . . 0.0 110.878 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.868 0.842 . . . . 0.0 109.628 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -63.57 -29.82 71.02 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.482 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.461 HD22 ' HB3' ' A' ' 763' ' ' LEU . 0.1 OUTLIER -59.77 -45.27 92.77 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -179.393 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.02 -39.51 90.03 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.617 0.722 . . . . 0.0 109.322 177.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -64.64 -39.58 93.94 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.7 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -59.51 -38.74 81.75 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-O 121.109 0.481 . . . . 0.0 111.32 -179.615 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mt -58.63 -36.99 74.95 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.786 -0.571 . . . . 0.0 111.837 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 776' ' ' LEU . . . . . 0.479 HD12 ' N ' ' A' ' 776' ' ' LEU . 6.9 mp -74.04 -44.91 52.64 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.925 -0.484 . . . . 0.0 111.954 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 7.5 pt -64.4 -37.31 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.552 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 778' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 774' ' ' LEU . 79.3 t -57.45 -46.74 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.521 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 37.4 p -63.84 -35.99 82.44 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.21 1.005 . . . . 0.0 110.546 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -45.46 74.28 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.349 -0.842 . . . . 0.0 112.9 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 781' ' ' ILE . . . . . 0.531 HG13 HG21 ' B' ' 746' ' ' ILE . 11.6 pt -69.64 -36.77 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.39 -38.32 79.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.561 0 O-C-N 121.438 -0.789 . . . . 0.0 109.392 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -60.89 -43.47 98.44 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-O 121.545 0.688 . . . . 0.0 109.794 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.63 -39.57 84.66 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.59 0.71 . . . . 0.0 110.44 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 785' ' ' LEU . . . . . 0.496 HD21 ' HG2' ' B' ' 747' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.537 0.451 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.58 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.486 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.571 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.1 mm? 61.82 116.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.649 0.738 . . . . 0.0 110.529 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 177.65 178.45 0.32 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.396 0.617 . . . . 0.0 109.988 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.551 ' CD1' HD13 ' C' ' 660' ' ' LEU . 14.8 tp -50.97 -56.35 12.85 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 122.349 1.071 . . . . 0.0 110.71 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -20.21 65.92 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.793 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -81.15 -44.59 17.66 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.329 0.585 . . . . 0.0 110.25 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -74.91 -46.38 36.3 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.512 0.672 . . . . 0.0 111.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.82 63.39 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.559 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 54.4 p -71.58 -31.19 66.68 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.884 -0.51 . . . . 0.0 111.142 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.451 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.9 mm? -59.7 -30.72 68.99 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.09 0.472 . . . . 0.0 110.682 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -59.76 -22.9 62.74 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.06 0.457 . . . . 0.0 111.048 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.92 -24.92 23.47 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.148 0.499 . . . . 0.0 111.453 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.93 -51.61 66.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.281 0.562 . . . . 0.0 111.255 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 57.53 37.59 27.7 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.876 0.846 . . . . 0.0 110.724 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -140.06 -80.5 0.28 Allowed 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.843 -0.535 . . . . 0.0 110.461 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tt -68.2 -35.78 72.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 121.657 -0.652 . . . . 0.0 111.156 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -50.53 -33.41 21.52 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 121.982 -0.449 . . . . 0.0 111.716 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.72 -49.95 75.43 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.6 OUTLIER -65.88 -41.58 91.41 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 121.895 0.855 . . . . 0.0 109.591 177.521 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.492 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -62.22 -35.98 80.55 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -177.666 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -106.85 -26.31 11.3 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -79.57 -11.83 59.87 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.483 -0.761 . . . . 0.0 111.898 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.6 pt -60.66 -36.2 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.919 -0.488 . . . . 0.0 110.322 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -52.88 -47.35 67.93 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.29 -0.256 . . . . 0.0 110.682 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.487 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.3 mp -69.66 -36.11 68.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.5 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.9 -29.39 68.32 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.967 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.995 HD12 HG21 ' A' ' 686' ' ' ILE . 14.4 mm -61.21 -45.72 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 O-C-N 121.79 -0.569 . . . . 0.0 109.614 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 64.7 mt -65.63 -42.5 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.86 -37.78 68.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 685' ' ' PHE . 49.9 t -59.85 -48.88 86.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.76 -27.33 12.69 Favored Glycine 0 CA--C 1.541 1.693 0 O-C-N 121.691 -0.631 . . . . 0.0 112.054 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.1 m -60.65 -42.3 96.7 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.33 -32.75 70.37 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.457 -0.777 . . . . 0.0 112.108 -177.3 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.86 -47.83 85.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 O-C-N 121.704 -0.622 . . . . 0.0 109.618 -178.824 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.433 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -62.36 -32.83 84.25 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.548 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.7 tt -53.91 -36.43 62.72 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.287 1.042 . . . . 0.0 110.031 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.748 ' HG3' HD11 ' A' ' 693' ' ' ILE . 25.8 mmt180 -55.02 -27.63 45.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 124.104 0.961 . . . . 0.0 112.505 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.33 -36.1 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 O-C-N 120.832 -1.168 . . . . 0.0 108.844 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.548 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.7 p -64.51 -30.81 51.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.422 -0.799 . . . . 0.0 109.967 177.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.9 m-85 -56.65 -31.01 63.97 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.833 -0.542 . . . . 0.0 109.681 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.93 -37.52 76.89 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -41.57 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 176.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.9 tp -58.39 -39.12 78.8 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.825 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 50.2 m -64.07 -36.62 84.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.436 0.636 . . . . 0.0 109.813 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.464 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.3 OUTLIER -62.23 -43.28 99.19 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.28 1.038 . . . . 0.0 109.136 178.22 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 705' ' ' VAL . . . . . 0.718 HG22 HD23 ' B' ' 748' ' ' LEU . 93.8 t -69.82 -45.47 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.717 179.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 706' ' ' ASN . . . . . 0.485 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 7.6 m-20 -62.92 -39.64 95.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.404 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -48.59 60.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 0.0 111.401 -177.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.5 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.4 OUTLIER -76.66 -42.55 34.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -176.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.53 -45.24 94.57 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 710' ' ' GLN . . . . . 0.658 ' O ' HD11 ' B' ' 715' ' ' LEU . 5.5 pt20 -104.84 -24.54 12.87 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 144.5 160.18 8.39 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -100.79 -70.64 0.73 Allowed 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.731 -0.864 . . . . 0.0 112.795 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 713' ' ' SER . . . . . 0.411 ' O ' ' C ' ' B' ' 714' ' ' PRO . 1.6 m -63.24 159.46 48.62 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.717 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 714' ' ' PRO . . . . . 0.411 ' C ' ' O ' ' B' ' 713' ' ' SER . 3.7 Cg_exo -28.44 108.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 122.651 2.234 . . . . 0.0 112.614 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 715' ' ' LEU . . . . . 0.814 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.6 tt -75.94 -11.91 60.05 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 122.159 0.98 . . . . 0.0 111.942 -178.723 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 739' ' ' GLU . . . . . 0.457 ' CD ' HD23 ' A' ' 765' ' ' LEU . 31.3 tp10 . . . . . 0 N--CA 1.464 0.249 0 CA-C-O 121.798 0.809 . . . . 0.0 111.405 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -30.16 65.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.266 -178.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.0 -8.39 2.29 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -35.66 80.77 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.538 -0.726 . . . . 0.0 111.13 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -58.74 -42.39 88.67 Favored 'General case' 0 C--N 1.344 0.33 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -71.43 -35.56 70.98 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.834 177.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.2 m -57.1 -37.73 72.35 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.065 -0.397 . . . . 0.0 110.227 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 746' ' ' ILE . . . . . 0.531 HG21 HG13 ' A' ' 781' ' ' ILE . 1.4 mp -55.68 -17.69 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.564 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 747' ' ' ARG . . . . . 0.496 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.2 OUTLIER -59.52 -29.66 68.04 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.149 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 748' ' ' LEU . . . . . 0.718 HD23 HG22 ' B' ' 705' ' ' VAL . 12.7 tp -55.7 -18.54 8.32 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.082 0.468 . . . . 0.0 110.05 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 42.5 t -55.69 -53.34 38.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.658 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -71.96 -18.87 61.96 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.795 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 751' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.16 -20.46 35.54 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.053 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 67.5 p -58.6 -38.14 77.34 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.849 -0.795 . . . . 0.0 109.408 179.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.84 -50.73 63.55 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.461 0.648 . . . . 0.0 109.62 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.84 -35.53 81.43 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.3 tt -59.84 -45.51 92.2 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.794 -0.567 . . . . 0.0 110.756 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.29 -37.78 80.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.652 0.739 . . . . 0.0 109.178 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.08 -30.31 68.6 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.342 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 758' ' ' ASP . . . . . 0.406 ' OD2' HD23 ' C' ' 715' ' ' LEU . 70.7 m-20 -55.58 -49.79 71.8 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.844 -1.16 . . . . 0.0 109.281 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.67 -45.89 60.58 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.42 0.628 . . . . 0.0 112.45 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 -46.72 65.37 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 8.9 ttm-85 -64.26 -49.94 69.91 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -177.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 3.0 m -62.27 -43.56 98.55 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.999 -0.438 . . . . 0.0 111.684 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 763' ' ' LEU . . . . . 0.589 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -60.89 -53.84 52.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.509 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 60.2 p -98.06 -49.24 4.83 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.396 0.617 . . . . 0.0 112.348 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 24.6 tp 69.15 102.92 0.06 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.867 0.842 . . . . 0.0 110.333 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 42.6 t80 64.6 -77.93 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.925 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 20.0 m -95.73 151.82 19.02 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.597 -0.689 . . . . 0.0 111.356 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.26 -30.88 43.28 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.864 0.364 . . . . 0.0 110.5 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -53.34 -40.44 64.9 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.92 0.867 . . . . 0.0 109.357 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.1 tpt85 -58.24 -29.49 65.79 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.578 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.95 -34.96 72.38 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -64.14 -35.03 79.46 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.98 -46.95 73.06 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 774' ' ' LEU . . . . . 0.628 ' HG ' HD11 ' B' ' 777' ' ' ILE . 1.5 tt -63.25 -37.98 89.37 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.953 0.882 . . . . 0.0 110.264 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 775' ' ' LEU . . . . . 0.566 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.3 OUTLIER -60.97 -37.06 81.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.836 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 776' ' ' LEU . . . . . 0.531 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.48 -44.86 63.95 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.931 -0.481 . . . . 0.0 111.688 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 777' ' ' ILE . . . . . 0.628 HD11 ' HG ' ' B' ' 774' ' ' LEU . 1.7 pp -64.5 -36.97 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.734 -0.604 . . . . 0.0 109.49 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 778' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' B' ' 781' ' ' ILE . 51.8 t -57.31 -46.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 O-C-N 121.678 -0.639 . . . . 0.0 111.028 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 779' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.8 t -63.5 -35.57 80.88 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.557 -0.714 . . . . 0.0 112.158 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -31.5 71.81 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.68 -0.638 . . . . 0.0 111.308 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 781' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' B' ' 778' ' ' VAL . 79.8 mt -60.42 -42.69 91.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.081 -0.387 . . . . 0.0 111.585 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 782' ' ' VAL . . . . . 0.601 HG22 ' O ' ' B' ' 779' ' ' THR . 6.7 m -54.93 -38.81 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.334 -0.854 . . . . 0.0 110.061 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.32 -45.56 92.68 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.596 0.713 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 17.5 tp -66.12 -43.97 85.6 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.293 0.568 . . . . 0.0 111.078 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 785' ' ' LEU . . . . . 0.463 HD23 ' CG ' ' C' ' 750' ' ' ASN . 4.2 tp -77.12 -16.47 59.16 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.074 0.464 . . . . 0.0 111.273 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.3 -48.11 15.91 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.88 106.99 19.38 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.524 -179.467 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.551 HD13 ' CD1' ' B' ' 663' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 121.496 0.665 . . . . 0.0 109.286 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.526 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.8 mp 60.68 120.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.621 0.725 . . . . 0.0 111.555 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.55 169.21 3.13 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.426 0.631 . . . . 0.0 110.059 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.732 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.3 OUTLIER -57.08 -52.07 66.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.763 0.792 . . . . 0.0 109.679 179.357 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.624 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -72.71 -17.15 61.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.853 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -81.07 -44.26 18.27 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.027 0.441 . . . . 0.0 111.189 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -63.95 -46.28 85.41 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.45 0.643 . . . . 0.0 110.284 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.48 -26.53 68.76 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.533 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -63.75 -37.97 89.37 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.047 0.451 . . . . 0.0 111.723 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.18 -34.78 74.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.869 0.366 . . . . 0.0 111.629 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -59.67 -21.96 61.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.036 0.446 . . . . 0.0 111.285 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -79.61 -24.54 41.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.173 0.511 . . . . 0.0 111.26 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -58.77 -37.63 76.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.507 0.67 . . . . 0.0 110.352 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 59.09 27.48 16.45 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.008 178.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.71 -68.81 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.548 -0.72 . . . . 0.0 112.227 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.703 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -58.05 -37.93 64.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.517 0.675 . . . . 0.0 111.083 -178.877 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.54 -33.84 47.36 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.958 -0.463 . . . . 0.0 111.149 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -62.95 -50.03 72.42 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.037 0.446 . . . . 0.0 110.343 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.701 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.69 -44.2 86.92 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.284 0.564 . . . . 0.0 109.801 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.559 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.55 -35.76 82.01 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.06 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -95.51 -33.52 12.4 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -75.36 -16.37 60.39 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.788 -0.57 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.701 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.0 pp -60.54 -36.77 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.877 -0.514 . . . . 0.0 110.304 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.556 ' N ' HD12 ' C' ' 682' ' ' ILE . 9.5 ttt-85 -57.04 -47.34 81.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.216 0.531 . . . . 0.0 110.005 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.427 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -66.81 -35.73 75.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.406 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.81 -32.03 70.26 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.867 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.942 HG21 HD12 ' A' ' 686' ' ' ILE . 9.6 mm -60.86 -49.51 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.327 0.584 . . . . 0.0 109.95 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -65.27 -36.94 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.8 -37.94 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.406 HG23 ' O ' ' C' ' 685' ' ' PHE . 73.5 t -55.73 -39.99 58.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.18 -40.32 91.44 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 9.8 m -63.26 -39.41 94.53 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 122.167 0.984 . . . . 0.0 109.817 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -46.15 89.2 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.318 -177.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.85 -42.12 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 694' ' ' GLY . . . . . 0.622 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.51 -32.28 77.4 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.66 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.3 tt -58.22 -38.41 76.74 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.997 0.903 . . . . 0.0 109.645 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -55.95 -28.13 55.6 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.622 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.8 tt -58.06 -36.35 56.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 120.924 -1.11 . . . . 0.0 111.141 -175.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.66 HG12 ' O ' ' C' ' 695' ' ' LEU . 13.9 p -54.86 -29.51 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 121.402 -0.812 . . . . 0.0 109.375 176.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.43 -31.58 64.06 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.171 -0.956 . . . . 0.0 109.619 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 700' ' ' ALA . . . . . 0.434 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.48 -43.01 97.41 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 52.7 t -68.33 -36.24 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.698 177.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.82 -37.03 82.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.366 0.667 . . . . 0.0 109.773 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.6 m -62.19 -36.45 81.95 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.219 0.533 . . . . 0.0 110.518 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -41.35 97.91 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 122.153 0.977 . . . . 0.0 108.708 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 705' ' ' VAL . . . . . 0.533 ' HA ' HD11 ' C' ' 748' ' ' LEU . 60.5 t -65.58 -44.53 93.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-O 122.176 0.988 . . . . 0.0 108.952 178.244 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.35 -35.88 80.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.333 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -49.69 75.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 121.685 -0.634 . . . . 0.0 110.532 -178.126 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -44.67 32.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.435 0.636 . . . . 0.0 111.766 -178.179 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -73.36 -39.85 64.84 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.377 -178.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -102.67 -18.89 15.0 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 102.31 171.11 27.08 Favored Glycine 0 CA--C 1.536 1.348 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 712' ' ' TYR . . . . . 0.464 ' O ' HD11 ' B' ' 704' ' ' LEU . 15.1 p90 -119.13 -54.29 2.22 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.681 -0.893 . . . . 0.0 112.297 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 713' ' ' SER . . . . . 0.5 ' HA ' HG21 ' B' ' 708' ' ' VAL . 87.6 p -94.44 159.42 33.84 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-O 118.752 -0.642 . . . . 0.0 110.423 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -39.55 103.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.668 1.579 . . . . 0.0 111.749 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 715' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' C' ' 716' ' ' SER . 27.7 tp -85.81 -19.89 30.0 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 716' ' ' SER . . . . . 0.479 ' C ' ' O ' ' C' ' 715' ' ' LEU . 35.5 t . . . . . 0 N--CA 1.5 2.052 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.58 0.705 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -61.7 -33.26 73.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.346 0.593 . . . . 0.0 111.088 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -58.32 -38.23 76.7 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.113 0.482 . . . . 0.0 110.95 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 742' ' ' ARG . . . . . 0.464 ' HD2' HD11 ' B' ' 774' ' ' LEU . 26.2 mtm105 -63.24 -42.67 99.23 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 122.175 -0.328 . . . . 0.0 111.153 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -58.03 -38.42 76.2 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.41 0.624 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -71.1 -42.54 69.17 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.375 0.607 . . . . 0.0 109.573 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.28 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.123 -0.361 . . . . 0.0 111.051 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 746' ' ' ILE . . . . . 0.416 HG21 ' HB ' ' B' ' 781' ' ' ILE . 1.5 mp -57.58 -21.0 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 120.039 -0.664 . . . . 0.0 109.717 178.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -59.67 -28.13 66.99 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.359 -0.838 . . . . 0.0 109.074 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 748' ' ' LEU . . . . . 0.591 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.2 tt -55.98 -24.49 39.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 53.8 t -55.59 -54.6 24.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 750' ' ' ASN . . . . . 0.463 ' CG ' HD23 ' B' ' 785' ' ' LEU . 6.9 m120 -72.9 -26.76 61.54 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.094 0.95 . . . . 0.0 109.233 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.32 -20.83 38.12 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.241 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 74.7 m -60.51 -38.02 83.0 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.919 -0.754 . . . . 0.0 109.429 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.61 -50.1 54.12 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.352 0.596 . . . . 0.0 110.159 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.71 80.24 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -60.38 -45.46 93.46 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.311 0.577 . . . . 0.0 110.383 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 54.5 mt -65.62 -36.91 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.894 0.854 . . . . 0.0 108.717 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.22 -30.6 68.79 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.933 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -55.56 -46.01 77.22 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.571 -0.706 . . . . 0.0 110.244 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.25 -41.9 72.91 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.283 0.563 . . . . 0.0 110.987 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -33.34 75.5 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -81.95 -38.93 24.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -44.52 61.89 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.246 -0.909 . . . . 0.0 109.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 763' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' C' ' 771' ' ' LEU . 5.2 tt -64.23 -53.66 45.63 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.502 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 764' ' ' SER . . . . . 0.528 ' HB2' HD12 ' C' ' 771' ' ' LEU . 46.6 t -97.81 -49.24 4.89 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.529 -0.732 . . . . 0.0 112.496 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.17 98.53 0.07 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 122.036 0.922 . . . . 0.0 110.914 -178.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 62.9 t80 48.88 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.417 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 20.3 t -73.9 154.01 39.59 Favored 'General case' 0 C--N 1.346 0.418 0 O-C-N 121.325 -0.859 . . . . 0.0 110.598 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 768' ' ' TYR . . . . . 0.469 ' CE2' HD13 ' C' ' 771' ' ' LEU . 0.3 OUTLIER -76.24 -19.46 58.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.93 0.395 . . . . 0.0 110.761 179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -43.72 88.37 Favored 'General case' 0 C--N 1.345 0.375 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.5 mmt-85 -58.73 -30.77 67.72 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.487 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 771' ' ' LEU . . . . . 0.744 ' O ' HD23 ' C' ' 771' ' ' LEU . 4.4 tt -60.67 -32.6 71.79 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.08 0.467 . . . . 0.0 109.842 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.31 -37.78 70.39 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -63.98 -34.72 78.64 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 774' ' ' LEU . . . . . 0.472 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -58.64 -38.68 78.62 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-O 121.074 0.464 . . . . 0.0 110.355 179.404 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 775' ' ' LEU . . . . . 0.426 ' O ' HG22 ' C' ' 778' ' ' VAL . 4.1 mm? -59.24 -43.25 92.39 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.564 0.697 . . . . 0.0 110.623 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 50.3 mt -74.34 -34.7 63.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.603 0.716 . . . . 0.0 110.182 178.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.03 -43.15 95.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.523 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 778' ' ' VAL . . . . . 0.527 HG12 HG12 ' A' ' 746' ' ' ILE . 34.6 m -64.93 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.191 -179.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 779' ' ' THR . . . . . 0.773 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.2 OUTLIER -63.79 -48.11 78.21 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.843 -0.535 . . . . 0.0 111.784 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -31.41 71.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.143 0.497 . . . . 0.0 111.769 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 781' ' ' ILE . . . . . 0.558 ' CD1' HD13 ' A' ' 746' ' ' ILE . 21.2 mt -57.85 -36.88 57.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 782' ' ' VAL . . . . . 0.773 HG22 ' O ' ' C' ' 779' ' ' THR . 33.9 m -53.2 -37.77 28.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.518 0 CA-C-N 119.35 0.977 . . . . 0.0 110.94 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 . . . . . 0 CA--C 1.543 0.685 0 O-C-N 121.855 -0.528 . . . . 0.0 112.074 -179.84 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.616 ' N ' HD23 ' C' ' 663' ' ' LEU . 1.4 mt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 69.0 mt 57.97 116.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.981 0.896 . . . . 0.0 112.117 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -176.63 175.04 1.76 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.532 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.425 ' C ' HD23 ' A' ' 663' ' ' LEU . 10.3 tt -50.67 -39.87 52.17 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.504 0.668 . . . . 0.0 110.837 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -74.37 -36.07 63.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.51 0.671 . . . . 0.0 111.7 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -43.21 78.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 111.301 -179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -67.16 -46.27 74.5 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.498 0.666 . . . . 0.0 110.242 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.59 -38.0 83.4 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.469 0.652 . . . . 0.0 110.758 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.8 m -60.41 -33.82 73.05 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.347 0.594 . . . . 0.0 111.115 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.0 tp -61.28 -25.52 67.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.87 0.367 . . . . 0.0 111.605 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -59.84 -25.87 65.35 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.766 -0.584 . . . . 0.0 110.799 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -64.12 -27.28 68.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.204 0.526 . . . . 0.0 111.15 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -59.68 -52.51 65.2 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.766 0.793 . . . . 0.0 110.215 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 26.1 t80 64.12 24.72 13.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.116 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -143.5 -61.93 0.4 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.67 -0.644 . . . . 0.0 111.338 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.7 tp -67.58 -37.68 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.395 0.617 . . . . 0.0 110.574 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -52.95 -34.24 54.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -67.33 -50.14 61.23 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.218 0.533 . . . . 0.0 111.31 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.554 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.6 OUTLIER -66.2 -43.35 87.0 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.425 0.631 . . . . 0.0 109.823 179.027 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.414 HD23 HG13 ' A' ' 675' ' ' ILE . 2.3 mm? -66.37 -35.91 81.53 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -99.58 8.37 44.5 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -176.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -120.24 -10.89 9.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.514 -0.742 . . . . 0.0 112.088 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.554 HG23 ' O ' ' A' ' 678' ' ' TRP . 6.8 pt -61.6 -35.73 68.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 121.867 -0.521 . . . . 0.0 110.527 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -47.29 68.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.036 -0.415 . . . . 0.0 110.765 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.455 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -68.86 -35.96 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.534 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.7 OUTLIER -59.96 -28.12 67.39 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.427 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.923 HD12 HG21 ' C' ' 686' ' ' ILE . 18.2 mm -60.79 -46.14 96.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.284 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 62.6 mt -64.67 -38.48 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.2 -37.19 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.3 t -54.55 -40.4 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.66 -39.37 85.94 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 177.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.3 m -66.66 -38.36 86.7 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.722 0.772 . . . . 0.0 109.413 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.39 -46.31 89.03 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.72 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.746 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.99 -40.56 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.439 -179.561 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.47 -24.2 61.37 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -38.2 82.76 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.88 0.848 . . . . 0.0 109.632 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.6 mmt180 -55.5 -28.17 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.486 0.715 . . . . 0.0 112.243 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.15 -39.42 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -177.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.76 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.63 -30.49 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 O-C-N 121.609 -0.682 . . . . 0.0 109.704 176.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -55.95 -29.06 59.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.92 0.39 . . . . 0.0 110.445 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.04 71.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.76 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -59.56 -35.85 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.025 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.73 -39.45 77.33 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 58.1 m -62.72 -38.29 89.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.581 0.705 . . . . 0.0 109.794 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -45.72 93.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.31 1.052 . . . . 0.0 108.571 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.53 HG22 HD12 ' A' ' 748' ' ' LEU . 93.3 t -62.35 -45.27 99.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.12 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 706' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 3.2 m120 -62.68 -38.45 90.44 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.244 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.656 HH21 HG23 ' A' ' 708' ' ' VAL . 4.5 tmm_? -62.61 -45.94 90.57 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.805 -0.559 . . . . 0.0 111.0 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.656 HG23 HH21 ' A' ' 707' ' ' ARG . 1.2 t -76.19 -42.01 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-O 122.233 1.016 . . . . 0.0 109.033 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -70.56 -18.93 62.92 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 710' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 18.6 tt0 -86.72 -13.47 45.25 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.499 0.666 . . . . 0.0 111.876 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 97.09 46.61 2.38 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.1 t80 52.18 -127.73 2.41 Favored 'General case' 0 CA--C 1.564 1.5 0 O-C-N 122.0 -0.706 . . . . 0.0 109.8 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 66.2 m -62.25 130.9 93.41 Favored Pre-proline 0 C--N 1.347 0.49 0 O-C-N 120.987 -1.071 . . . . 0.0 109.378 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.507 ' CG ' HD21 ' C' ' 748' ' ' LEU . 71.9 Cg_exo -43.59 106.62 0.08 OUTLIER 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 121.111 1.207 . . . . 0.0 111.922 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -99.61 -5.4 29.09 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.44 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 3.8 t . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 122.507 1.146 . . . . 0.0 109.18 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 121.872 0.844 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -57.74 -26.09 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.634 0.73 . . . . 0.0 110.739 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.8 -22.78 26.34 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.665 ' O ' HD12 ' A' ' 746' ' ' ILE . 5.8 mtm105 -65.63 -46.62 78.56 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.663 -0.648 . . . . 0.0 112.472 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -44.62 91.52 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.75 -0.594 . . . . 0.0 110.827 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -40.15 72.48 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.125 -0.36 . . . . 0.0 111.331 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 61.9 p -65.5 -33.46 75.98 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 122.203 -0.311 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.4 OUTLIER -63.17 -46.45 95.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.28 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.944 ' HB3' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -62.09 -8.71 5.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.171 -1.412 . . . . 0.0 111.313 -177.733 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 705' ' ' VAL . 0.2 OUTLIER -55.73 -14.94 2.55 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 746' ' ' ILE 0.316 1.9 t -52.97 -54.59 16.06 Favored 'Isoleucine or valine' 0 C--N 1.35 0.595 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 176.385 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.48 ' ND2' ' NH2' ' A' ' 747' ' ' ARG . 7.1 m120 -73.36 -28.58 62.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.06 -1.427 . . . . 0.0 109.103 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.78 -19.9 30.57 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.035 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 78.6 p -57.93 -37.74 74.64 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 36.8 tp -62.1 -50.87 70.2 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.16 72.4 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.629 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.441 ' C ' HD23 ' A' ' 755' ' ' LEU . 9.9 tt -58.97 -44.05 91.48 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.62 -0.675 . . . . 0.0 110.768 -178.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.8 mt -61.56 -36.97 76.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.62 68.84 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.228 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.656 ' OD2' HD22 ' B' ' 715' ' ' LEU . 51.5 m-20 -55.58 -43.85 76.36 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.383 0.611 . . . . 0.0 109.805 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.46 -41.08 73.26 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 110.682 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.65 -33.54 76.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.711 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -77.42 -30.84 53.66 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 6.5 p -77.33 -45.25 26.73 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.359 -0.838 . . . . 0.0 110.342 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.462 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -68.12 -53.72 23.3 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -178.183 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 92.0 p -98.13 -49.15 4.84 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.538 -0.726 . . . . 0.0 112.69 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 17.4 tp 101.29 -87.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.318 1.447 . . . . 0.0 110.689 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -110.8 -70.68 0.8 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.468 -0.77 . . . . 0.0 110.976 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.4 t -87.25 158.74 19.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.201 0.524 . . . . 0.0 110.322 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -83.11 13.26 4.23 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.037 0.446 . . . . 0.0 111.529 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -98.93 -41.73 7.46 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.622 0.725 . . . . 0.0 109.321 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -56.04 -29.91 61.13 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.753 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -31.02 69.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.051 -0.406 . . . . 0.0 111.244 -177.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ptt85 -57.49 -40.18 78.07 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.612 0.72 . . . . 0.0 109.637 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.39 -42.98 74.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.048 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.3 tt -60.57 -38.42 84.5 Favored 'General case' 0 C--N 1.349 0.56 0 CA-C-O 121.438 0.637 . . . . 0.0 110.459 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -35.76 72.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.146 0.974 . . . . 0.0 109.328 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.95 -44.95 65.01 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.399 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.716 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -65.82 -37.3 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.91 -0.494 . . . . 0.0 111.056 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.716 ' N ' HD13 ' A' ' 777' ' ' ILE . 17.4 m -60.81 -46.54 96.0 Favored 'Isoleucine or valine' 0 C--N 1.35 0.588 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.271 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.78 ' O ' HG22 ' A' ' 782' ' ' VAL . 7.2 m -64.22 -36.91 85.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-O 121.824 0.821 . . . . 0.0 109.674 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 780' ' ' ARG . . . . . 0.442 ' HD3' HD13 ' A' ' 784' ' ' LEU . 2.2 ttt85 -65.58 -30.35 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.944 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.74 HG21 ' CG2' ' B' ' 746' ' ' ILE . 3.5 tp -53.49 -36.57 27.92 Favored 'Isoleucine or valine' 0 C--N 1.348 0.529 0 O-C-N 121.887 -0.508 . . . . 0.0 111.28 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 779' ' ' THR . 16.7 m -55.09 -38.11 45.19 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 C-N-CA 119.354 -0.939 . . . . 0.0 110.271 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -64.91 -46.58 81.11 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.509 0.671 . . . . 0.0 110.756 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.442 HD13 ' HD3' ' A' ' 780' ' ' ARG . 7.2 mp -64.47 -40.9 96.56 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.527 0.679 . . . . 0.0 111.39 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 59.4 tp -87.22 -10.74 51.74 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 121.102 0.477 . . . . 0.0 111.746 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -76.43 -32.47 51.3 Favored Glycine 0 CA--C 1.534 1.239 0 O-C-N 121.853 -0.529 . . . . 0.0 111.943 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 152.15 45.89 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.649 0.737 . . . . 0.0 111.106 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.97 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.435 HD12 ' N ' ' B' ' 660' ' ' LEU . 7.0 mp . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.561 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.0 mm? 60.92 116.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.313 0.577 . . . . 0.0 110.506 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -173.72 161.98 3.98 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.347 0.594 . . . . 0.0 109.64 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.538 HD11 HD13 ' C' ' 660' ' ' LEU . 9.4 tt -55.41 -43.99 75.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.656 0.741 . . . . 0.0 110.31 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.18 -28.62 67.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.376 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.0 tptt -75.57 -48.9 20.36 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.045 0.45 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.416 ' CE2' HD22 ' C' ' 661' ' ' LEU . 83.7 m95 -58.55 -45.99 87.77 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.616 0.722 . . . . 0.0 110.39 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.22 66.66 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.681 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 27.6 t -72.32 -26.82 62.09 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.987 0.422 . . . . 0.0 111.545 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.37 -39.16 92.26 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.964 -0.46 . . . . 0.0 111.602 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -59.73 -20.36 56.0 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.931 -0.481 . . . . 0.0 111.355 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -82.07 -24.43 35.26 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.292 0.568 . . . . 0.0 111.006 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -68.9 -47.27 66.22 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.511 0.672 . . . . 0.0 110.626 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 44.2 t80 58.28 32.17 21.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.68 0.752 . . . . 0.0 111.31 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -140.26 -70.83 0.38 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.815 -0.553 . . . . 0.0 110.662 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.15 -37.5 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 121.848 -0.532 . . . . 0.0 111.081 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -52.56 -35.46 53.81 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 24.7 m120 -62.83 -50.08 72.36 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.493 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.503 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.7 t90 -66.24 -43.77 85.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.982 0.896 . . . . 0.0 109.638 177.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.66 -35.72 78.75 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.127 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -94.79 -50.83 4.97 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -53.33 -18.2 2.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.802 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.9 pp -60.51 -36.65 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.759 -0.588 . . . . 0.0 110.544 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 683' ' ' ARG . . . . . 0.802 ' N ' HD12 ' B' ' 682' ' ' ILE . 14.1 ttt-85 -58.25 -47.46 83.49 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.908 -0.495 . . . . 0.0 110.93 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.477 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.04 -34.48 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -27.94 69.2 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.253 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.813 HD12 HG21 ' A' ' 686' ' ' ILE . 18.5 mm -60.7 -50.87 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.417 0.627 . . . . 0.0 110.213 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.68 -40.4 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.27 0.557 . . . . 0.0 109.524 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.52 -38.9 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.85 -48.12 90.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.51 -27.0 10.89 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.769 -0.582 . . . . 0.0 111.744 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 5.4 m -60.81 -45.27 95.09 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.619 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.26 -32.39 69.96 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.651 -0.656 . . . . 0.0 112.546 -176.61 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.619 ' H ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.88 -46.36 87.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 O-C-N 121.725 -0.609 . . . . 0.0 110.165 -178.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.98 -31.73 79.61 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.64 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.2 tt -57.66 -36.55 72.04 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.493 1.139 . . . . 0.0 110.389 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.746 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.5 mmt180 -55.59 -28.88 57.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -36.68 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.907 -1.121 . . . . 0.0 110.251 -176.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.64 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.36 -30.85 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.444 -0.785 . . . . 0.0 110.92 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -56.71 -31.42 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.857 -0.527 . . . . 0.0 110.404 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.4 80.37 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.51 -38.06 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.96 -37.68 88.47 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.157 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 59.6 p -64.06 -34.55 78.27 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.212 0.53 . . . . 0.0 110.743 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -43.12 94.73 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.129 0.966 . . . . 0.0 109.161 178.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' B' ' 748' ' ' LEU . 93.5 t -68.98 -44.92 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.15 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.54 -36.15 81.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -62.04 -50.03 73.63 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 122.071 0.939 . . . . 0.0 109.999 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.562 ' CG1' HD12 ' B' ' 748' ' ' LEU . 1.7 t -77.57 -44.07 29.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.921 -1.036 . . . . 0.0 113.239 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -57.79 -44.24 86.13 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 6.6 pt20 -103.79 -23.76 13.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.58 128.51 3.0 Favored Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -71.19 -60.55 2.17 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.75 152.28 90.59 Favored Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 121.152 -0.967 . . . . 0.0 110.58 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.461 ' HG3' HD23 ' A' ' 748' ' ' LEU . 69.4 Cg_exo -32.72 113.49 0.06 OUTLIER 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.563 2.176 . . . . 0.0 112.501 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.656 HD22 ' OD2' ' A' ' 758' ' ' ASP . 6.0 tt -77.3 -16.33 59.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 122.097 0.951 . . . . 0.0 112.126 -178.976 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 121.002 0.43 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -28.15 63.16 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.081 0.467 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.16 -7.12 3.66 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.692 HH11 HD11 ' A' ' 777' ' ' ILE . 8.2 ttp-105 -68.19 -40.25 82.28 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.806 -0.559 . . . . 0.0 111.623 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.11 -43.68 87.31 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.243 0.544 . . . . 0.0 109.715 -179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 744' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' B' ' 747' ' ' ARG . 0.0 OUTLIER -71.33 -39.33 71.45 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.188 178.085 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.6 p -56.94 -34.41 67.97 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 121.326 -0.858 . . . . 0.0 110.957 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.74 ' CG2' HG21 ' A' ' 781' ' ' ILE . 87.1 mt -52.88 -25.2 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.478 -0.773 . . . . 0.0 112.287 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 744' ' ' ARG . 0.0 OUTLIER -59.67 -28.48 67.31 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.783 1.629 . . . . 0.0 109.132 179.802 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.562 HD12 ' CG1' ' B' ' 708' ' ' VAL . 3.5 mt -55.9 -16.36 4.56 Favored 'General case' 0 C--N 1.353 0.741 0 O-C-N 121.75 -0.594 . . . . 0.0 110.696 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 31.8 t -56.54 -54.13 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 106.978 -1.489 . . . . 0.0 106.978 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -72.68 -16.37 61.69 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.473 175.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.19 -20.58 36.21 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.716 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 14.4 m -58.72 -37.93 77.2 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.999 0.9 . . . . 0.0 109.882 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.78 -51.05 37.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.483 0.658 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.92 76.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.232 0.539 . . . . 0.0 111.67 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 755' ' ' LEU . . . . . 0.525 ' C ' HD23 ' B' ' 755' ' ' LEU . 9.5 tt -59.12 -45.36 91.13 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.907 -0.496 . . . . 0.0 110.734 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.4 mt -66.08 -36.27 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 122.135 0.969 . . . . 0.0 108.844 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.12 -29.53 69.3 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.834 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -54.94 -48.21 73.45 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.586 -0.697 . . . . 0.0 109.466 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.92 -45.48 64.19 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.14 -46.43 74.09 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -64.9 -29.74 70.7 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.819 -0.55 . . . . 0.0 112.372 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 80.0 p -75.71 -45.47 36.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.543 0.687 . . . . 0.0 110.95 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.439 ' O ' HD13 ' B' ' 774' ' ' LEU . 2.0 mp -61.07 -54.77 40.64 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 13.7 p -98.71 -49.62 4.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.528 0.68 . . . . 0.0 112.678 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 12.8 tp 71.1 99.66 0.06 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.718 0.77 . . . . 0.0 110.47 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.89 -80.94 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.207 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 17.6 p -84.31 158.32 21.22 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.638 -0.664 . . . . 0.0 110.558 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 768' ' ' TYR . . . . . 0.516 ' CE2' HD13 ' B' ' 771' ' ' LEU . 18.3 t80 -89.52 -31.76 17.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.96 0.409 . . . . 0.0 110.902 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.26 -37.71 64.99 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.999 0.904 . . . . 0.0 109.199 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -56.22 -29.77 61.41 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.546 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' B' ' 768' ' ' TYR . 10.0 tt -59.65 -41.0 89.54 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.905 -0.497 . . . . 0.0 109.698 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -57.74 -42.91 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.94 -46.17 90.5 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.439 HD13 ' O ' ' B' ' 763' ' ' LEU . 0.8 OUTLIER -59.25 -37.77 78.41 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.741 0.782 . . . . 0.0 109.997 178.284 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.624 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.5 OUTLIER -58.07 -36.91 73.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.074 -178.423 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 49.5 mt -70.71 -48.34 55.09 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.585 -0.697 . . . . 0.0 111.364 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 18.4 pt -62.58 -36.12 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.899 0.38 . . . . 0.0 109.98 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.411 HG23 HG12 ' C' ' 746' ' ' ILE . 0.4 OUTLIER -54.81 -45.79 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.11 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.606 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -63.83 -36.03 82.56 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.641 0.734 . . . . 0.0 110.492 178.381 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -67.08 -37.88 84.75 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 64.1 mt -63.92 -41.59 93.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.999 -0.438 . . . . 0.0 111.266 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.606 HG22 ' O ' ' B' ' 779' ' ' THR . 6.8 m -58.14 -38.58 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 121.282 -0.886 . . . . 0.0 110.176 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -59.97 -42.08 93.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.725 0.774 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.59 -43.36 85.1 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.605 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.783 HD23 ' HB2' ' C' ' 750' ' ' ASN . 5.9 tp -82.36 -18.31 42.56 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 122.05 -0.406 . . . . 0.0 111.604 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -50.76 -42.94 46.76 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 118.89 36.62 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.759 -179.414 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.538 HD13 HD11 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.429 ' N ' HD12 ' C' ' 661' ' ' LEU . 8.3 mp 59.02 109.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.712 0.768 . . . . 0.0 110.807 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -173.11 165.74 4.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.488 0.661 . . . . 0.0 110.243 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.677 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -50.7 -55.74 15.14 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.486 0.66 . . . . 0.0 110.591 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.677 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.6 t70 -71.03 -19.66 62.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.538 . . . . 0.0 112.384 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -80.61 -44.71 18.48 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.074 -0.391 . . . . 0.0 111.187 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -64.64 -45.76 85.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.407 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.24 -19.3 65.78 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.936 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 15.7 p -72.17 -28.63 63.35 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.815 -0.553 . . . . 0.0 111.327 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.33 -38.66 87.7 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 122.106 -0.372 . . . . 0.0 111.621 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -59.58 -29.79 68.2 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.599 -0.688 . . . . 0.0 110.985 -178.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -63.94 -31.99 73.36 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.472 0.653 . . . . 0.0 110.624 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -63.31 -41.65 98.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.495 0.664 . . . . 0.0 110.371 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 52.18 36.75 20.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.542 0.687 . . . . 0.0 111.334 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -146.59 -72.0 0.23 Allowed 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.604 -0.685 . . . . 0.0 111.338 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' C' ' 678' ' ' TRP . 6.2 tp -67.78 -37.5 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.952 -0.468 . . . . 0.0 110.981 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -52.24 -34.69 47.16 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -66.06 -50.15 65.17 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.712 -0.618 . . . . 0.0 110.451 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.426 ' CE3' HD12 ' C' ' 675' ' ' ILE . 1.3 t90 -65.81 -43.85 87.4 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 121.617 0.722 . . . . 0.0 109.727 178.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.469 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -64.05 -35.89 82.22 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.98 -8.0 22.81 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -97.81 -11.66 23.06 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.378 -0.826 . . . . 0.0 112.927 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.91 -36.6 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 O-C-N 121.744 -0.597 . . . . 0.0 110.499 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.517 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.8 ttt-85 -54.09 -47.42 71.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.776 0.322 . . . . 0.0 111.1 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.467 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.2 mp -68.81 -35.95 71.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.79 -32.37 70.55 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.92 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.923 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.61 -44.34 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.35 -41.62 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.88 -37.69 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.475 ' O ' HG23 ' C' ' 693' ' ' ILE . 94.0 t -54.95 -39.8 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.22 -42.52 82.44 Favored Glycine 0 C--N 1.346 1.137 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.4 -38.7 90.74 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.991 0.9 . . . . 0.0 109.021 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 tp -59.87 -43.99 94.42 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.083 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.475 HG23 ' O ' ' C' ' 689' ' ' VAL . 1.2 pp -65.63 -41.86 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.979 -0.45 . . . . 0.0 109.91 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -64.25 -27.74 71.99 Favored Glycine 0 CA--C 1.537 1.429 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.604 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -60.86 -39.46 89.25 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.877 0.846 . . . . 0.0 110.113 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.25 -29.17 60.72 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.744 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.1 OUTLIER -59.26 -36.21 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -176.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.604 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.3 p -54.38 -30.6 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.317 -0.864 . . . . 0.0 110.631 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -56.45 -31.32 63.86 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.999 -0.438 . . . . 0.0 110.281 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.72 79.0 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 177.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -43.44 92.8 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 122.07 0.938 . . . . 0.0 108.565 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.9 -37.67 87.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.403 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.3 m -62.76 -39.17 93.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.196 0.522 . . . . 0.0 110.343 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.494 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.7 OUTLIER -62.12 -44.98 95.46 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.21 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.62 -45.16 99.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.85 0.833 . . . . 0.0 108.892 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -62.6 -37.0 84.54 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.373 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.31 -49.78 71.29 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -36.02 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.36 0.6 . . . . 0.0 111.95 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -70.36 -44.25 68.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.04 -21.49 13.92 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.01 178.54 17.8 Favored Glycine 0 CA--C 1.537 1.448 0 N-CA-C 110.194 -1.162 . . . . 0.0 110.194 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -132.9 -54.42 0.93 Allowed 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.896 -0.767 . . . . 0.0 112.328 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.448 ' HA ' HG21 ' B' ' 708' ' ' VAL . 1.7 m -71.66 142.0 85.62 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-O 118.776 -0.63 . . . . 0.0 109.309 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -30.06 96.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 123.101 2.534 . . . . 0.0 113.195 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.48 18.5 2.25 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.492 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.838 0.827 . . . . 0.0 109.647 -179.115 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.997 0.904 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -69.19 -26.47 64.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.143 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -64.71 -36.99 86.08 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.472 ' O ' HD12 ' C' ' 746' ' ' ILE . 42.6 ptt85 -74.34 -38.57 63.22 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.27 -37.47 75.05 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.941 -1.099 . . . . 0.0 109.337 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -71.43 -37.04 71.48 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.885 0.374 . . . . 0.0 110.475 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 18.9 p -67.94 -35.28 78.15 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.831 -0.543 . . . . 0.0 111.243 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.472 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -59.5 -22.2 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -59.47 -30.05 68.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.507 HD21 ' CG ' ' A' ' 714' ' ' PRO . 0.2 OUTLIER -61.74 -16.35 48.58 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.539 178.747 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 44.5 t -55.53 -54.47 25.2 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.783 ' HB2' HD23 ' B' ' 785' ' ' LEU . 4.2 m120 -72.53 -24.64 61.17 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 122.223 1.011 . . . . 0.0 108.547 174.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -20.13 32.54 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.996 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 42.7 m -58.44 -40.71 83.32 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 117.546 0.673 . . . . 0.0 109.332 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 22.6 tp -62.85 -51.14 68.16 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 754' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -58.91 -34.4 71.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.713 0.768 . . . . 0.0 111.28 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.478 ' C ' HD23 ' C' ' 755' ' ' LEU . 10.0 tt -58.56 -45.25 89.35 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.489 -176.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 756' ' ' ILE . . . . . 0.431 HG22 HD12 ' C' ' 760' ' ' LEU . 2.3 mp -69.73 -29.54 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.68 -31.64 69.8 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -55.43 -47.17 76.38 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.937 -1.102 . . . . 0.0 109.622 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.59 -45.27 65.67 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 760' ' ' LEU . . . . . 0.431 HD12 HG22 ' C' ' 756' ' ' ILE . 14.0 mt -66.32 -45.98 78.47 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -66.61 -49.64 65.66 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 23.0 p -67.51 -40.89 85.14 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.68 -0.637 . . . . 0.0 111.042 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -54.47 15.97 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.4 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -97.75 -49.37 4.85 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.304 -0.873 . . . . 0.0 112.331 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 6.5 tp 78.17 83.62 0.07 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 122.088 0.947 . . . . 0.0 111.042 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.17 -81.01 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.389 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 16.8 p -86.5 165.97 15.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.529 -0.732 . . . . 0.0 111.683 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -28.52 29.46 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -52.88 -37.16 60.14 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.964 0.888 . . . . 0.0 108.932 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 71.4 mmt-85 -69.31 -30.9 69.06 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.628 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.4 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.6 tt -60.97 -35.35 76.56 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.738 -0.601 . . . . 0.0 109.961 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -57.34 -35.18 69.58 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -63.06 -42.08 99.6 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.663 HD13 HG22 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -63.25 -38.52 91.47 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-O 122.057 0.932 . . . . 0.0 109.104 177.868 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.465 ' O ' HG22 ' C' ' 778' ' ' VAL . 0.2 OUTLIER -58.11 -43.18 87.02 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.737 -0.602 . . . . 0.0 110.036 -179.396 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.13 -35.58 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.337 0.589 . . . . 0.0 110.737 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.663 HG22 HD13 ' C' ' 774' ' ' LEU . 2.7 tt -65.17 -37.59 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.158 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.659 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -63.39 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.323 -0.861 . . . . 0.0 110.642 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.801 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.6 m -64.42 -48.72 74.28 Favored 'General case' 0 C--N 1.344 0.331 0 O-C-N 121.833 -0.542 . . . . 0.0 112.085 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -31.56 71.74 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.389 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 19.6 mt -54.96 -36.15 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 122.215 -0.303 . . . . 0.0 110.649 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.801 HG22 ' O ' ' C' ' 779' ' ' THR . 23.0 m -52.87 -38.09 27.48 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 O-C-N 121.256 -0.902 . . . . 0.0 110.944 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -54.88 -41.31 70.71 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.333 0.587 . . . . 0.0 111.188 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 24.1 tp -68.83 -44.82 72.64 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.944 HD22 ' HB3' ' A' ' 747' ' ' ARG . 5.6 tp -74.99 -27.9 60.34 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 119.586 1.084 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -41.63 -49.08 4.94 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -97.15 115.42 27.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.841 0.829 . . . . 0.0 109.654 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 10.3 tpt85 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.794 -178.953 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.489 ' CB ' HD23 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.689 0.757 . . . . 0.0 109.128 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 33.4 mt 59.52 106.75 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.978 0.894 . . . . 0.0 110.797 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 179.41 -178.62 0.37 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.18 -46.04 86.46 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 121.363 -0.836 . . . . 0.0 109.696 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.9 -33.02 73.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.463 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 -49.05 11.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 111.007 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -64.8 -40.72 95.7 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 110.685 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.12 62.58 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.703 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -29.98 64.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.17 0.51 . . . . 0.0 111.001 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -59.78 -36.78 77.38 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.057 -0.402 . . . . 0.0 110.898 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -59.71 -17.4 34.33 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.884 0.373 . . . . 0.0 111.384 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.68 -29.02 21.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.334 0.588 . . . . 0.0 110.661 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -59.9 -48.97 79.51 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.681 0.753 . . . . 0.0 110.576 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 60.25 40.03 18.39 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.892 0.853 . . . . 0.0 110.58 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -71.06 0.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.923 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.403 HD12 ' CE3' ' A' ' 678' ' ' TRP . 6.9 tp -68.25 -37.51 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 121.957 -0.464 . . . . 0.0 111.326 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.15 -35.73 49.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -64.71 -50.14 68.14 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.376 0.608 . . . . 0.0 110.568 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.568 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.7 t90 -65.53 -43.05 91.21 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.675 0.75 . . . . 0.0 109.997 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -35.62 81.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -102.82 -3.15 26.76 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -109.37 -5.61 15.77 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.346 0.975 . . . . 0.0 112.729 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 678' ' ' TRP . 10.7 pt -68.48 -36.13 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 110.779 179.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -53.26 -41.73 65.79 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.254 0.549 . . . . 0.0 110.047 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.478 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -76.8 -34.96 23.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 177.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.481 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.4 t80 -59.84 -38.93 83.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.169 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.671 HG21 HD12 ' B' ' 686' ' ' ILE . 1.4 mp -60.6 -45.58 97.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 86.3 mt -61.73 -39.55 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.481 HD12 ' HA ' ' A' ' 685' ' ' PHE . 94.5 mt -59.85 -37.73 73.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.982 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 693' ' ' ILE . 93.3 t -54.85 -40.04 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.49 83.48 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 16.4 m -62.14 -38.68 89.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.04 0.924 . . . . 0.0 109.606 177.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.29 -39.33 86.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.923 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.667 HG22 HG21 ' C' ' 693' ' ' ILE . 0.9 OUTLIER -65.7 -43.17 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-O 121.153 0.501 . . . . 0.0 110.39 -178.278 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.12 92.96 Favored Glycine 0 CA--C 1.535 1.321 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.1 tt -53.5 -38.7 63.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 122.278 1.037 . . . . 0.0 110.045 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -57.02 -28.82 62.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.091 0.956 . . . . 0.0 112.362 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 40.7 mt -59.51 -36.54 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 O-C-N 121.502 -0.749 . . . . 0.0 110.438 -176.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.797 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.5 p -66.49 -30.51 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.468 -0.77 . . . . 0.0 110.763 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -55.59 -28.53 55.61 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.547 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.4 -36.9 71.89 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.797 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.8 m -61.17 -36.6 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.533 -0.729 . . . . 0.0 109.578 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.9 tp -57.62 -37.64 73.61 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.995 -0.44 . . . . 0.0 110.429 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 16.0 m -62.24 -40.49 96.35 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.442 0.639 . . . . 0.0 109.997 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.426 HD13 HH22 ' A' ' 707' ' ' ARG . 0.4 OUTLIER -60.59 -43.17 97.68 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.527 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.449 HG22 HD12 ' A' ' 748' ' ' LEU . 78.4 t -64.71 -45.01 96.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 CA-C-O 121.858 0.837 . . . . 0.0 109.101 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.84 -36.2 80.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.876 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.426 HH22 HD13 ' A' ' 704' ' ' LEU . 2.1 tmm_? -65.71 -49.52 68.2 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.22 0.534 . . . . 0.0 111.668 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.423 HG23 ' NH2' ' A' ' 707' ' ' ARG . 1.0 OUTLIER -76.32 -44.06 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.921 0.867 . . . . 0.0 110.279 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -63.37 -22.09 66.67 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 710' ' ' GLN . . . . . 0.449 ' NE2' HD21 ' C' ' 755' ' ' LEU . 2.4 mt-30 -92.85 -21.77 19.68 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.181 -0.949 . . . . 0.0 112.114 -178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 111.79 35.42 1.86 Allowed Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 71.97 -171.93 0.15 Allowed 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.28 1.038 . . . . 0.0 111.502 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 3.7 m -62.46 161.25 27.65 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.499 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -12.51 92.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 124.56 3.507 . . . . 0.0 115.692 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -106.83 -17.16 14.28 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.919 -179.533 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 78.8 p . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 122.292 1.044 . . . . 0.0 110.932 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-O 121.922 0.868 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -26.1 65.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.296 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -55.79 -6.79 0.24 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.22 -41.54 88.87 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.273 -0.892 . . . . 0.0 109.757 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.614 ' HA ' HD13 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -67.04 -45.19 78.2 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.143 0.497 . . . . 0.0 110.442 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -30.86 71.32 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.275 0.559 . . . . 0.0 110.651 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 13.1 p -67.53 -46.56 72.47 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.621 HG21 HD12 ' C' ' 781' ' ' ILE . 1.5 mt -61.46 -47.0 95.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.803 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.641 ' NE ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.91 -7.55 11.9 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 117.844 -1.543 . . . . 0.0 111.278 -177.465 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.475 HD23 ' HG3' ' B' ' 714' ' ' PRO . 0.2 OUTLIER -60.21 -14.82 19.61 Favored 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 171.092 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.454 HG12 ' OD1' ' A' ' 750' ' ' ASN 0.291 1.6 t -53.06 -55.15 13.57 Favored 'Isoleucine or valine' 0 C--N 1.356 0.884 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 177.294 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.458 ' ND2' ' NH1' ' A' ' 747' ' ' ARG . 7.6 m120 -73.32 -27.64 61.64 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.924 174.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.81 -19.59 29.56 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 89.0 p -57.49 -37.28 72.69 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.86 -48.09 82.11 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.66 -34.88 71.73 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.011 0.434 . . . . 0.0 110.54 177.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.85 -45.07 90.95 Favored 'General case' 0 C--N 1.345 0.397 0 O-C-N 121.981 -0.449 . . . . 0.0 111.412 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.54 -33.08 55.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.16 -30.14 68.31 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.374 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.472 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.0 m-20 -55.16 -45.75 75.7 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.43 -0.794 . . . . 0.0 109.846 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.94 -44.35 69.75 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.473 0.654 . . . . 0.0 111.237 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -37.48 87.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -67.51 -44.56 78.15 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.245 0.545 . . . . 0.0 111.796 -178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.6 t -64.88 -45.18 87.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.962 0.887 . . . . 0.0 111.499 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.686 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -64.58 -54.15 36.58 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -177.786 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 764' ' ' SER . . . . . 0.462 ' OG ' HD12 ' A' ' 771' ' ' LEU . 1.4 m -98.45 -22.99 15.74 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 8.9 tp 77.07 -60.53 0.46 Allowed 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.733 -0.604 . . . . 0.0 109.886 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.96 -67.72 0.29 Allowed 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.019 -0.425 . . . . 0.0 111.108 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.0 m -93.27 155.07 17.65 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.036 0.446 . . . . 0.0 110.531 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.97 -40.27 94.74 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.029 0.442 . . . . 0.0 110.323 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -53.94 -39.22 65.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.885 0.85 . . . . 0.0 109.664 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -58.47 -29.87 66.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.777 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.525 HD11 HD23 ' A' ' 763' ' ' LEU . 10.5 tt -59.56 -36.1 75.54 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 109.964 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -57.14 -33.34 67.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.484 0.659 . . . . 0.0 109.524 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -62.83 -42.36 99.7 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.817 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 763' ' ' LEU . 11.4 tp -58.83 -38.36 78.5 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 121.181 0.515 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.95 -39.83 93.44 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.158 0.504 . . . . 0.0 111.895 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 776' ' ' LEU . . . . . 0.544 ' O ' HG22 ' A' ' 779' ' ' THR . 39.6 mt -75.11 -42.16 57.02 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.81 -0.556 . . . . 0.0 112.395 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.555 HD11 HD12 ' A' ' 774' ' ' LEU . 1.1 pt -68.78 -37.51 77.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.731 -178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 774' ' ' LEU . 27.5 m -58.48 -42.65 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.543 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.688 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.9 t -63.57 -35.38 80.31 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 121.59 -0.694 . . . . 0.0 111.292 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.91 73.14 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.017 0.437 . . . . 0.0 111.692 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.437 ' CB ' HG21 ' B' ' 746' ' ' ILE . 24.4 mm -57.23 -41.97 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.996 -0.44 . . . . 0.0 111.439 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.688 HG22 ' O ' ' A' ' 779' ' ' THR . 10.4 m -54.95 -38.82 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.741 -0.6 . . . . 0.0 110.702 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -59.87 -48.84 80.07 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.327 0.584 . . . . 0.0 111.086 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.18 -43.37 70.92 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.4 -30.21 64.44 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 121.906 -0.496 . . . . 0.0 111.161 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.09 -30.39 23.5 Favored Glycine 0 CA--C 1.534 1.232 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 9.6 ptt180 -120.97 141.94 50.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.629 0.728 . . . . 0.0 110.975 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 . . . . . 0 C--O 1.22 -0.451 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.554 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.583 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.7 mm? 52.29 83.47 0.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.875 0.845 . . . . 0.0 110.539 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -150.79 157.81 43.39 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.685 0.755 . . . . 0.0 110.555 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.498 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.7 OUTLIER -47.0 -57.69 4.75 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 122.283 1.039 . . . . 0.0 111.559 -179.729 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.498 ' N ' HD23 ' B' ' 663' ' ' LEU . 12.3 m-20 -64.33 -28.92 70.04 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.437 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -71.62 -49.43 40.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.03 0.443 . . . . 0.0 110.401 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -61.95 -46.63 88.44 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.355 0.597 . . . . 0.0 110.518 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.36 -21.49 66.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.7 t -70.67 -32.9 70.34 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 111.038 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 669' ' ' LEU . 4.4 mm? -60.46 -31.53 70.52 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.402 0.62 . . . . 0.0 111.087 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -59.61 -21.11 59.93 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.185 0.516 . . . . 0.0 111.321 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -86.8 -26.8 23.92 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.16 0.505 . . . . 0.0 111.216 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -60.13 -48.44 81.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.419 0.628 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.2 t80 59.82 40.86 18.91 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 122.027 0.917 . . . . 0.0 110.817 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.61 -72.05 0.2 Allowed 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.856 -0.528 . . . . 0.0 110.687 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -68.42 -37.22 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 O-C-N 121.961 -0.462 . . . . 0.0 111.303 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -52.36 -33.96 45.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -69.02 -50.14 51.43 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.604 -0.685 . . . . 0.0 110.875 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.728 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.4 t90 -65.76 -44.26 86.4 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.824 0.821 . . . . 0.0 109.126 178.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.17 -35.89 81.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -95.9 -21.0 18.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -95.95 -5.27 41.72 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.285 -0.885 . . . . 0.0 112.17 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.728 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.3 pt -62.59 -36.65 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.721 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -53.04 -47.36 68.47 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.979 0.419 . . . . 0.0 110.62 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.474 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -66.57 -35.33 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.51 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.34 -31.12 70.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.957 179.475 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.671 HD12 HG21 ' A' ' 686' ' ' ILE . 19.2 mm -60.8 -44.72 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 109.856 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.34 -41.07 88.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.305 0.574 . . . . 0.0 109.502 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.11 -38.79 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 685' ' ' PHE . 54.0 t -57.63 -39.71 71.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 690' ' ' GLY . . . . . 0.429 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -64.64 -26.77 71.18 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.4 m -60.62 -46.6 89.66 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.587 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.91 -33.34 71.74 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -176.521 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.587 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.84 -41.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 -178.697 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.584 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.67 -34.3 88.08 Favored Glycine 0 CA--C 1.537 1.413 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.602 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.0 tt -59.72 -37.04 77.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.224 1.012 . . . . 0.0 110.506 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -55.93 -28.54 57.3 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.584 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.4 tt -58.63 -36.08 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 O-C-N 121.169 -0.957 . . . . 0.0 110.696 -176.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -54.52 -30.26 21.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 O-C-N 121.859 -0.526 . . . . 0.0 110.899 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -55.98 -30.0 61.1 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.729 -0.607 . . . . 0.0 110.389 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.42 -40.81 83.49 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.455 HG22 ' O ' ' B' ' 698' ' ' VAL . 1.3 m -69.35 -35.99 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tp -51.65 -37.76 51.81 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.815 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 43.0 m -62.82 -38.82 92.25 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.751 0.786 . . . . 0.0 109.948 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.454 HD22 ' NH1' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -62.13 -43.15 99.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.429 1.109 . . . . 0.0 108.801 178.603 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.581 HG22 HD11 ' B' ' 748' ' ' LEU . 57.6 t -67.67 -40.64 84.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.695 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' B' ' 710' ' ' GLN . 7.9 m-20 -62.4 -37.61 86.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.028 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.454 ' NH1' HD22 ' B' ' 704' ' ' LEU . 11.1 mtm105 -68.13 -44.31 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.152 0.977 . . . . 0.0 111.273 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.55 -45.35 33.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -65.88 -45.84 80.57 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 118.877 -1.129 . . . . 0.0 112.96 -175.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 0.9 OUTLIER -105.57 -24.16 12.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 -179.372 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.95 164.03 10.94 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -102.49 -61.58 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.5 p -65.55 158.81 72.01 Favored Pre-proline 0 N--CA 1.468 0.427 0 O-C-N 121.316 -0.865 . . . . 0.0 109.637 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.475 ' HG3' HD23 ' A' ' 748' ' ' LEU . 87.3 Cg_exo -29.32 118.59 0.05 OUTLIER 'Trans proline' 0 N--CA 1.496 1.676 0 C-N-CA 122.784 2.323 . . . . 0.0 112.981 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 758' ' ' ASP . 5.0 tt -83.65 -19.01 36.14 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 122.535 1.159 . . . . 0.0 111.282 -178.844 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 122.082 0.944 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 42.1 mtp85 -72.59 -25.87 61.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.254 -0.884 . . . . 0.0 113.201 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.13 -9.38 0.39 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -176.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 1.4 mtm105 -60.45 -37.62 81.54 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.406 -0.809 . . . . 0.0 110.175 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.22 -29.85 66.03 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.043 0.449 . . . . 0.0 109.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -49.39 43.44 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 121.532 0.682 . . . . 0.0 109.647 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -59.85 -33.92 72.44 Favored 'General case' 0 N--CA 1.46 0.068 0 O-C-N 122.026 -0.422 . . . . 0.0 110.214 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.437 HG21 ' CB ' ' A' ' 781' ' ' ILE . 1.5 mp -58.07 -22.02 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 31.8 ttt-85 -59.58 -17.32 31.89 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.581 HD11 HG22 ' B' ' 705' ' ' VAL . 7.2 tt -55.03 -27.04 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 749' ' ' VAL . . . . . 0.421 HG23 ' O ' ' B' ' 746' ' ' ILE . 94.7 t -55.05 -53.82 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -72.66 -24.32 61.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.331 -1.304 . . . . 0.0 109.837 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.54 37.81 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.242 -178.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 24.7 m -59.43 -38.7 81.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 117.857 0.828 . . . . 0.0 109.656 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 26.0 tp -69.54 -47.13 64.71 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.49 0.662 . . . . 0.0 110.179 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.59 -35.44 77.37 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 755' ' ' LEU . . . . . 0.494 HD22 ' O ' ' B' ' 755' ' ' LEU . 1.7 tm? -59.51 -45.34 92.0 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.06 -0.4 . . . . 0.0 111.665 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.76 -36.81 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 121.377 0.608 . . . . 0.0 110.011 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.97 -30.59 69.05 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.483 ' OD2' HD23 ' C' ' 715' ' ' LEU . 85.7 m-20 -55.91 -49.75 72.59 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.04 -1.038 . . . . 0.0 109.934 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -70.8 -42.56 70.14 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.31 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.6 -45.98 70.54 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -65.36 -20.48 66.41 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 762' ' ' SER . . . . . 0.472 ' O ' HD22 ' B' ' 774' ' ' LEU . 1.6 m -76.6 -45.64 29.37 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.768 -0.582 . . . . 0.0 111.326 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -54.87 14.42 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 5.3 t -98.97 -49.83 4.39 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.855 0.836 . . . . 0.0 112.294 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.3 tt 63.86 89.34 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.825 0.822 . . . . 0.0 109.384 -177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 13.1 t80 72.74 122.11 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.514 0.673 . . . . 0.0 111.222 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.0 m 57.82 164.26 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.316 0.579 . . . . 0.0 111.451 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -109.84 64.31 0.61 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.781 1.277 . . . . 0.0 110.395 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.25 -42.51 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 122.474 1.13 . . . . 0.0 108.115 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -55.94 -29.03 59.5 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.527 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.738 ' O ' HD23 ' B' ' 771' ' ' LEU . 6.4 tt -59.38 -31.09 68.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.247 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -43.02 99.59 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -68.99 -45.2 71.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.634 . . . . 0.0 109.807 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.507 HD21 ' CZ ' ' C' ' 742' ' ' ARG . 0.1 OUTLIER -60.34 -37.87 81.98 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.752 0.787 . . . . 0.0 109.998 178.834 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.686 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.7 tm? -58.03 -36.8 73.24 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.673 -0.642 . . . . 0.0 110.007 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.4 mt -71.78 -38.22 70.33 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.103 -0.373 . . . . 0.0 111.884 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 777' ' ' ILE . . . . . 0.5 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.4 pp -69.4 -37.45 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.52 -0.738 . . . . 0.0 109.877 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 83.5 t -60.53 -46.6 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.42 -0.8 . . . . 0.0 110.012 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.793 ' O ' HG22 ' B' ' 782' ' ' VAL . 2.6 t -63.85 -41.11 97.88 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.852 -0.53 . . . . 0.0 112.413 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.63 72.08 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.716 -0.615 . . . . 0.0 111.91 -178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.8 mt -57.88 -37.03 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 O-C-N 121.78 -0.575 . . . . 0.0 111.049 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 779' ' ' THR . 16.1 m -54.49 -38.14 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.301 -0.875 . . . . 0.0 110.012 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -64.33 -44.61 90.99 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.342 0.592 . . . . 0.0 110.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.08 -42.12 80.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.467 0.651 . . . . 0.0 111.253 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.408 HD23 ' CG ' ' C' ' 750' ' ' ASN . 8.2 tp -76.98 -20.29 56.27 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.245 0.545 . . . . 0.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -55.84 -28.21 52.12 Favored Glycine 0 CA--C 1.534 1.229 0 O-C-N 122.005 -0.435 . . . . 0.0 112.107 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.17 128.24 54.53 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.809 -0.818 . . . . 0.0 110.633 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.454 179.524 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.792 0.806 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.6 142.9 11.24 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -173.2 176.0 3.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.443 0.639 . . . . 0.0 110.975 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.489 HD23 ' CB ' ' A' ' 660' ' ' LEU . 2.5 tm? -52.94 -46.54 68.18 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 122.036 0.922 . . . . 0.0 110.943 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -64.53 -26.62 68.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.58 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -81.14 -42.38 20.99 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 110.412 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -60.71 -44.79 96.16 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.583 0.706 . . . . 0.0 110.613 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.71 -26.65 64.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.208 0.528 . . . . 0.0 111.646 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.4 t -61.33 -30.32 70.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.98 -0.45 . . . . 0.0 112.07 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.488 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.7 mm? -66.7 -39.51 88.11 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -59.8 -27.65 66.77 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.649 -0.657 . . . . 0.0 111.091 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -66.3 -32.86 74.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.292 0.567 . . . . 0.0 110.129 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -63.87 -40.93 97.7 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.792 0.806 . . . . 0.0 109.637 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.1 t80 62.16 12.24 4.93 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.978 0.732 . . . . 0.0 112.978 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -136.72 -59.94 0.71 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.566 -0.709 . . . . 0.0 112.592 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -63.41 -38.23 81.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.504 0.668 . . . . 0.0 110.731 -178.525 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.8 m -52.84 -38.57 61.61 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.173 0.511 . . . . 0.0 110.967 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -59.34 -49.05 79.3 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.622 0.725 . . . . 0.0 109.933 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.504 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -60.19 -43.4 95.92 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.167 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.21 -40.05 90.05 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -94.87 -10.04 32.5 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -94.6 -22.9 17.88 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.714 -0.616 . . . . 0.0 111.933 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.504 HG23 ' O ' ' C' ' 678' ' ' TRP . 13.4 pt -64.51 -36.9 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.93 -0.481 . . . . 0.0 110.738 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 7.5 ttt-85 -54.47 -47.22 73.22 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.488 ' O ' HD13 ' C' ' 688' ' ' ILE . 1.8 mp -64.67 -34.48 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.7 OUTLIER -60.34 -37.27 80.12 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.737 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.601 HD12 HG22 ' B' ' 686' ' ' ILE . 10.9 mm -61.08 -47.19 94.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.103 0.478 . . . . 0.0 109.749 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.04 -37.06 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.488 HD13 ' O ' ' C' ' 684' ' ' ILE . 1.2 mp -58.93 -38.87 75.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 65.4 t -58.55 -40.12 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.74 -36.29 65.17 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 12.1 m -67.31 -38.94 85.77 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.47 1.128 . . . . 0.0 110.222 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -46.49 89.16 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.425 -1.261 . . . . 0.0 114.053 -176.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.667 HG21 HG22 ' A' ' 693' ' ' ILE . 2.2 pp -59.91 -41.58 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 O-C-N 121.82 -0.55 . . . . 0.0 110.761 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.688 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.17 -37.06 92.33 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.97 -37.35 66.39 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.545 0.688 . . . . 0.0 109.955 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.552 HH22 HD12 ' B' ' 697' ' ' ILE . 25.4 mmt180 -56.71 -30.54 63.6 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.999 -0.438 . . . . 0.0 111.695 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.688 HG22 ' O ' ' C' ' 694' ' ' GLY . 13.4 tt -60.98 -36.89 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.8 t -67.13 -30.7 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.635 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -62.05 -30.99 71.36 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.108 0.48 . . . . 0.0 110.115 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.75 76.43 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -63.0 -39.71 86.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -37.98 87.46 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.677 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.0 m -62.82 -37.84 88.33 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.819 -0.551 . . . . 0.0 110.285 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.96 -41.71 98.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.813 0.816 . . . . 0.0 108.807 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.582 HG13 HD13 ' C' ' 748' ' ' LEU . 48.2 t -62.72 -44.67 99.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.266 1.031 . . . . 0.0 108.475 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -60.16 -35.6 75.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.117 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -47.95 83.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.707 0.765 . . . . 0.0 110.826 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -41.28 41.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.768 0.794 . . . . 0.0 110.769 -178.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -73.19 -33.6 65.51 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.684 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -102.29 -15.77 16.49 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 103.7 -173.06 21.54 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -132.22 -53.44 0.97 Allowed 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.544 -0.974 . . . . 0.0 112.749 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 8.4 m -93.94 146.5 31.78 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-O 118.28 -0.867 . . . . 0.0 109.641 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -31.31 93.56 0.01 OUTLIER 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.623 2.215 . . . . 0.0 112.811 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.483 HD23 ' OD2' ' B' ' 758' ' ' ASP . 17.2 tp -73.68 -10.42 59.67 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 716' ' ' SER . . . . . 0.439 ' C ' ' O ' ' C' ' 715' ' ' LEU . 14.2 t . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 121.19 0.519 . . . . 0.0 112.29 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -26.43 62.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.51 -47.85 82.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.507 ' CZ ' HD21 ' B' ' 774' ' ' LEU . 24.3 ttp85 -63.88 -36.83 85.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -58.73 -34.14 71.01 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.029 1.286 . . . . 0.0 109.268 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -71.22 -32.73 69.14 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.489 0.662 . . . . 0.0 109.655 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 5.0 p -66.5 -47.31 73.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.92 0.39 . . . . 0.0 110.078 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.0 mp -53.98 -41.07 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 O-C-N 121.404 -0.81 . . . . 0.0 110.737 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -60.99 -16.13 39.61 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 118.372 -1.331 . . . . 0.0 110.417 -178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.582 HD13 HG13 ' C' ' 705' ' ' VAL . 0.9 OUTLIER -63.27 -19.26 64.41 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.362 176.804 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.0 t -55.21 -54.03 28.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.725 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.408 ' CG ' HD23 ' B' ' 785' ' ' LEU . 6.2 m120 -72.53 -27.12 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.816 174.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.67 37.46 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.53 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 97.8 p -58.69 -38.82 79.07 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.038 -0.684 . . . . 0.0 109.356 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 20.8 tp -67.07 -49.02 66.46 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 754' ' ' ALA . . . . . 0.46 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.45 -35.42 74.02 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.644 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.532 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.9 tm? -59.65 -45.34 92.31 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.837 -0.539 . . . . 0.0 110.706 -178.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.35 -41.39 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.478 0.656 . . . . 0.0 109.266 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -68.4 -30.86 69.87 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.11 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -55.65 -49.48 72.77 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.347 -0.846 . . . . 0.0 110.009 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -71.12 -45.02 64.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.493 0.663 . . . . 0.0 111.049 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.44 -44.15 96.09 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -74.46 -47.5 33.11 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -177.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 79.3 p -67.34 -43.75 80.75 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.85 0.833 . . . . 0.0 111.196 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.417 ' HG ' HD22 ' C' ' 774' ' ' LEU . 8.7 tt -59.73 -53.22 60.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.636 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 34.3 m -96.79 -13.43 22.62 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 9.0 mt 57.27 67.69 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.954 0.883 . . . . 0.0 110.717 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 59.3 t80 79.07 -89.62 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 61.8 m -93.78 171.79 8.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.305 -0.872 . . . . 0.0 111.986 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.28 -33.61 67.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.224 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -54.4 -35.08 62.49 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.019 0.914 . . . . 0.0 108.812 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.25 -30.17 64.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.798 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -60.06 -35.13 74.47 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -33.9 67.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -41.36 98.85 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.486 HD11 HD11 ' A' ' 746' ' ' ILE . 6.7 tp -59.35 -38.98 81.76 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-O 121.142 0.496 . . . . 0.0 109.717 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.477 ' O ' HG12 ' C' ' 778' ' ' VAL . 1.8 mm? -58.91 -42.55 89.92 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.365 0.602 . . . . 0.0 110.729 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 35.8 mt -74.52 -37.21 63.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 109.668 178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.626 ' O ' HG13 ' C' ' 781' ' ' ILE . 71.4 mt -61.39 -49.06 86.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.123 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.477 HG12 ' O ' ' C' ' 775' ' ' LEU . 7.5 p -54.76 -39.18 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.753 ' O ' HG22 ' C' ' 782' ' ' VAL . 8.3 m -63.61 -43.16 97.69 Favored 'General case' 0 C--N 1.335 -0.052 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.679 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -31.86 72.02 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.626 HG13 ' O ' ' C' ' 777' ' ' ILE . 11.5 mt -56.48 -36.27 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.838 -0.539 . . . . 0.0 110.968 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.753 HG22 ' O ' ' C' ' 779' ' ' THR . 18.0 m -52.47 -37.86 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 121.432 -0.792 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.79 -41.59 87.05 Favored 'General case' 0 CA--C 1.553 1.07 0 O-C-N 121.452 -0.78 . . . . 0.0 111.465 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.6 -44.51 81.93 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.444 ' HB3' ' HD2' ' A' ' 747' ' ' ARG . 6.5 tp -71.28 -37.35 71.87 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.115 -0.99 . . . . 0.0 109.525 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.08 -33.34 37.12 Favored Glycine 0 CA--C 1.532 1.129 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.82 127.81 34.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.22 -0.447 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.327 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.553 ' HB2' HD21 ' C' ' 663' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 120.312 0.101 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.7 mt 170.25 119.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.505 -0.747 . . . . 0.0 109.576 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.06 -174.16 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.73 -0.606 . . . . 0.0 109.881 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.547 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.6 OUTLIER -54.34 -40.07 67.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.562 0.696 . . . . 0.0 109.855 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 664' ' ' ASP . . . . . 0.434 ' N ' HD23 ' A' ' 663' ' ' LEU . 0.6 OUTLIER -69.8 -34.74 74.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.779 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -73.53 -44.58 57.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.44 0.638 . . . . 0.0 110.657 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -72.8 -46.26 54.17 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.185 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.97 -30.58 70.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.084 0.469 . . . . 0.0 111.658 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.0 m -65.22 -32.34 73.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.255 0.55 . . . . 0.0 111.005 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.7 -30.57 71.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.861 0.362 . . . . 0.0 111.565 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -59.45 -24.46 63.55 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.708 -0.62 . . . . 0.0 111.195 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -73.3 -22.34 60.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.085 0.469 . . . . 0.0 111.265 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.9 m95 -64.48 -45.28 88.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-O 121.154 0.502 . . . . 0.0 111.171 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 673' ' ' PHE . . . . . 0.427 ' CG ' ' O ' ' A' ' 673' ' ' PHE . 49.3 t80 60.67 10.03 2.43 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.394 0.616 . . . . 0.0 111.027 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -123.9 -66.94 0.96 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.988 -1.07 . . . . 0.0 111.269 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.98 -37.67 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 122.059 -0.401 . . . . 0.0 111.392 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.5 m -52.7 -38.6 60.93 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -61.79 -50.07 73.83 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 121.271 0.558 . . . . 0.0 110.433 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.61 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.3 t90 -65.52 -39.35 91.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.78 0.8 . . . . 0.0 109.654 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -35.93 81.83 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -104.98 -20.01 13.66 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -84.75 -14.46 48.19 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.282 -0.886 . . . . 0.0 111.84 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.61 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.0 pt -60.82 -35.8 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.243 0.544 . . . . 0.0 110.513 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 -53.06 -47.02 68.77 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.151 -0.343 . . . . 0.0 110.346 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -65.96 -32.01 56.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -62.79 -29.86 71.03 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.158 179.684 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.805 HD12 HG21 ' C' ' 686' ' ' ILE . 21.2 mm -60.72 -45.4 97.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.16 0.505 . . . . 0.0 110.188 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.8 mt -71.12 -37.65 67.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.138 0.494 . . . . 0.0 109.776 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.02 -37.66 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 122.053 -0.404 . . . . 0.0 110.174 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 685' ' ' PHE . 67.4 t -54.61 -39.91 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 690' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -58.87 -38.77 93.0 Favored Glycine 0 CA--C 1.533 1.178 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.0 m -64.46 -38.3 90.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.815 0.817 . . . . 0.0 109.63 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -45.5 91.48 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.772 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.638 HG13 HG22 ' B' ' 693' ' ' ILE . 0.2 OUTLIER -67.38 -40.96 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.721 -179.2 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 694' ' ' GLY . . . . . 0.487 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -60.78 -21.62 58.64 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 177.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.517 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -62.53 -37.61 86.77 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.813 0.816 . . . . 0.0 109.788 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 3.0 mmt180 -55.02 -28.4 51.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 694' ' ' GLY . 20.4 tt -59.2 -36.79 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 O-C-N 120.559 -1.338 . . . . 0.0 109.427 -177.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.745 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -67.38 -30.92 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-O 121.514 0.673 . . . . 0.0 110.038 177.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.2 m-85 -55.61 -28.53 55.72 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.334 0.588 . . . . 0.0 109.733 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.0 -36.91 70.95 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.745 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -62.19 -35.72 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 O-C-N 121.59 -0.694 . . . . 0.0 109.485 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.6 -39.21 87.31 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.029 -0.419 . . . . 0.0 110.205 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -62.62 -33.82 75.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.512 0.672 . . . . 0.0 109.854 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.1 OUTLIER -62.9 -43.13 99.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.402 1.096 . . . . 0.0 108.745 177.972 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.825 HG22 HD23 ' A' ' 748' ' ' LEU . 67.1 t -67.77 -45.21 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.201 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.42 -37.08 84.43 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.512 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.431 ' CZ ' ' HE ' ' B' ' 707' ' ' ARG . 34.4 ttm180 -60.19 -49.46 77.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.894 0.854 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -43.05 49.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.001 0.905 . . . . 0.0 109.423 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.1 -14.59 61.88 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -98.41 7.68 45.87 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.011 -1.056 . . . . 0.0 113.427 -178.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 81.38 12.33 82.17 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.886 -0.509 . . . . 0.0 112.374 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.411 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.6 OUTLIER 61.94 -123.24 0.76 Allowed 'General case' 0 CA--C 1.564 1.492 0 O-C-N 121.648 -0.913 . . . . 0.0 110.774 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.411 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 13.4 p -62.22 159.1 41.78 Favored Pre-proline 0 C--N 1.355 0.832 0 O-C-N 120.732 -1.23 . . . . 0.0 110.625 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.413 ' HG3' ' HG ' ' C' ' 748' ' ' LEU . 84.8 Cg_exo -44.59 109.04 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.68 1.587 . . . . 0.0 112.836 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.22 -19.1 13.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.512 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 14.4 p . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 122.565 1.174 . . . . 0.0 110.427 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.838 0.828 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -25.62 62.65 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.71 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.54 -13.28 0.91 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 69.3 mtm-85 -69.19 -46.68 66.86 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.458 -0.777 . . . . 0.0 109.255 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.77 -41.46 86.67 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.746 0.784 . . . . 0.0 110.267 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 744' ' ' ARG . . . . . 0.858 ' HA ' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -69.31 -35.47 76.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.444 -0.785 . . . . 0.0 111.192 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.33 -38.39 81.49 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.07 -0.394 . . . . 0.0 111.793 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.762 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.5 mp -64.2 -47.1 91.38 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.258 0 CA-C-O 116.566 -1.683 . . . . 0.0 113.923 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.72 ' CB ' HD23 ' C' ' 785' ' ' LEU . 0.2 OUTLIER -64.78 -11.22 34.36 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 122.471 2.396 . . . . 0.0 110.644 -176.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.825 HD23 HG22 ' A' ' 705' ' ' VAL . 57.5 tp -56.15 -14.93 3.05 Favored 'General case' 0 CA--C 1.562 1.429 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.273 1.5 t -53.75 -54.17 21.37 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.608 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -72.36 -28.87 63.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 122.566 1.174 . . . . 0.0 108.289 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.661 ' HA3' HD12 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.32 Favored Glycine 0 C--N 1.339 0.726 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.181 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 79.8 p -57.36 -37.32 72.41 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.51 -47.49 85.38 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.13 -35.8 76.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.764 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.475 ' O ' HD23 ' A' ' 755' ' ' LEU . 6.7 tt -62.24 -45.34 93.76 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.292 0.568 . . . . 0.0 110.275 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 756' ' ' ILE . . . . . 0.412 HG22 HD12 ' A' ' 760' ' ' LEU . 52.8 mt -61.29 -36.88 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -69.45 -30.81 68.81 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.236 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.562 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 79.2 m-20 -57.9 -49.22 77.47 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.614 -0.679 . . . . 0.0 109.938 -178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -70.8 -43.42 68.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.019 0.528 . . . . 0.0 112.256 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.412 HD12 HG22 ' A' ' 756' ' ' ILE . 10.6 mt -68.73 -46.28 69.32 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 121.595 0.712 . . . . 0.0 112.565 -178.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -63.23 -25.4 68.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.292 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 61.6 p -74.3 -45.15 49.42 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.572 -0.705 . . . . 0.0 111.158 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.775 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -67.33 -55.52 13.49 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.092 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.43 -49.14 4.53 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.709 0.766 . . . . 0.0 112.173 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.476 ' C ' HD23 ' A' ' 765' ' ' LEU . 5.4 tt 82.98 -78.18 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.875 0.87 . . . . 0.0 111.644 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -109.99 -70.65 0.8 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.624 -0.672 . . . . 0.0 111.568 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.9 m -97.86 144.41 27.47 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.142 0.496 . . . . 0.0 110.604 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CE1' HD22 ' A' ' 771' ' ' LEU . 15.6 t80 -60.98 -29.54 69.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.997 0.427 . . . . 0.0 110.419 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -55.94 -36.65 68.0 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.882 0.849 . . . . 0.0 109.226 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.91 -29.6 60.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.671 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.69 HD11 HD23 ' A' ' 763' ' ' LEU . 29.5 tp -59.65 -43.53 93.87 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -59.53 -40.04 85.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.574 0.702 . . . . 0.0 109.394 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -68.0 -45.37 74.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.83 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 763' ' ' LEU . 0.2 OUTLIER -63.16 -38.41 91.05 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.392 0.615 . . . . 0.0 110.707 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.33 -39.88 88.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.9 -0.5 . . . . 0.0 111.168 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.9 mt -67.19 -40.64 86.55 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 17.8 pt -60.26 -36.93 71.69 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.56 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 35.2 t -55.59 -46.41 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.774 -0.579 . . . . 0.0 109.597 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.804 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.2 OUTLIER -63.92 -41.53 97.63 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.188 0.518 . . . . 0.0 110.856 179.358 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.87 72.49 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.44 -36.75 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 O-C-N 121.714 -0.616 . . . . 0.0 111.078 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 779' ' ' THR . 13.4 m -54.73 -40.26 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 O-C-N 121.471 -0.768 . . . . 0.0 111.46 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -65.28 -42.0 93.6 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.68 0.753 . . . . 0.0 111.178 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.9 tp -69.15 -38.79 78.95 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.327 0.584 . . . . 0.0 111.035 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.547 HD11 ' HG3' ' B' ' 747' ' ' ARG . 0.3 OUTLIER -78.53 -22.3 47.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.871 0.367 . . . . 0.0 111.312 -179.468 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.09 -39.75 12.58 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.9 128.59 35.36 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.493 0.663 . . . . 0.0 110.48 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 12.7 ttp-105 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.08 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.547 ' N ' HD12 ' A' ' 663' ' ' LEU . 3.0 tt . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.557 0.694 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.9 mp 61.02 103.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.575 0.702 . . . . 0.0 110.556 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -167.11 175.16 7.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.511 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.82 HD12 HD23 ' C' ' 660' ' ' LEU . 8.9 tt -53.59 -41.41 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.549 0.69 . . . . 0.0 110.363 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -73.31 -31.46 64.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.68 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -46.78 50.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.347 0.594 . . . . 0.0 110.777 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -64.38 -46.28 84.05 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.589 0.709 . . . . 0.0 110.394 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.37 -24.43 67.64 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.4 t -63.18 -35.01 78.89 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.229 0.537 . . . . 0.0 110.923 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.449 HD12 HG23 ' B' ' 675' ' ' ILE . 4.2 mm? -59.84 -28.12 67.22 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.211 0.529 . . . . 0.0 111.233 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -62.23 -23.53 66.71 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.048 0.452 . . . . 0.0 111.379 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -88.04 -26.6 22.49 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.238 0.542 . . . . 0.0 111.512 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -59.16 -49.11 79.12 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 111.014 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 59.3 41.34 20.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.799 0.809 . . . . 0.0 110.644 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -153.64 -71.33 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.802 -0.561 . . . . 0.0 111.224 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.465 HG13 HD23 ' B' ' 679' ' ' LEU . 6.5 tp -65.68 -37.21 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 O-C-N 121.869 -0.519 . . . . 0.0 111.344 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.26 -33.72 43.02 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -64.01 -49.88 70.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.439 0.638 . . . . 0.0 110.116 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.484 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.0 t90 -65.68 -39.86 91.75 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.828 0.823 . . . . 0.0 109.622 178.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.465 HD23 HG13 ' B' ' 675' ' ' ILE . 0.6 OUTLIER -66.12 -35.6 80.92 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.033 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -102.02 -31.2 10.77 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -68.81 -27.01 65.47 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.514 -0.741 . . . . 0.0 111.481 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.735 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.7 pp -60.42 -36.08 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 O-C-N 122.091 -0.381 . . . . 0.0 110.889 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 683' ' ' ARG . . . . . 0.735 ' N ' HD12 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -53.64 -47.23 70.51 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.281 0.563 . . . . 0.0 110.044 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.522 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.0 mp -76.06 -36.95 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -28.58 67.49 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.43 -44.78 96.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.54 -43.76 98.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.29 -37.86 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.433 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.407 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 42.4 t -55.81 -39.44 56.23 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -63.63 -27.46 71.02 Favored Glycine 0 CA--C 1.543 1.842 0 O-C-N 121.766 -0.584 . . . . 0.0 112.273 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 46.6 m -60.55 -44.55 96.0 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.624 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.43 -31.55 69.39 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 121.597 -0.69 . . . . 0.0 112.068 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.638 HG22 HG13 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -57.16 -44.69 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 O-C-N 121.438 -0.789 . . . . 0.0 109.237 -177.785 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.04 -32.07 80.94 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.442 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -55.54 -36.86 67.23 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.785 0.803 . . . . 0.0 109.89 178.866 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.1 mmt180 -54.67 -27.68 41.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.728 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.17 -36.02 55.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 O-C-N 120.85 -1.156 . . . . 0.0 109.325 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.442 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.0 p -61.78 -30.5 48.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 O-C-N 121.218 -0.926 . . . . 0.0 110.424 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 11.6 m-85 -56.62 -31.41 64.28 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.708 -0.62 . . . . 0.0 110.429 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.34 88.06 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.17 -38.78 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.13 -39.95 91.94 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.363 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -68.37 -33.59 74.54 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.579 0.704 . . . . 0.0 110.01 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -42.78 93.09 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.158 0.98 . . . . 0.0 108.956 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.16 -45.13 77.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 122.153 0.977 . . . . 0.0 109.176 178.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.53 -36.59 83.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.336 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.431 ' HE ' ' CZ ' ' A' ' 707' ' ' ARG . 18.3 ttm180 -62.07 -47.12 86.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.25 1.024 . . . . 0.0 109.485 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.6 t -70.28 -44.4 77.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.038 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.47 -44.97 95.34 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.562 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.4 pt20 -104.46 -24.46 13.04 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.11 176.18 14.35 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' A' ' 704' ' ' LEU . 0.9 OUTLIER -96.03 -65.05 1.0 Allowed 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.727 -0.867 . . . . 0.0 111.596 -179.224 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 42.9 p -69.48 159.61 82.82 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.353 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.594 ' HG3' HD13 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -31.63 142.3 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.361 2.041 . . . . 0.0 113.152 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.479 ' O ' HD23 ' B' ' 715' ' ' LEU . 8.3 tt -95.2 -18.9 20.5 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 715' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 122.326 1.06 . . . . 0.0 112.505 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.464 0.65 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -57.99 -26.32 62.2 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.332 0.587 . . . . 0.0 112.369 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -52.34 63.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.62 ' NH2' HD11 ' A' ' 774' ' ' LEU . 9.9 ptt85 -77.72 -34.47 52.66 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -45.06 90.6 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.093 -1.004 . . . . 0.0 108.809 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -71.46 -34.05 69.87 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.283 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 4.3 p -57.28 -38.29 73.7 Favored 'General case' 0 C--N 1.344 0.342 0 O-C-N 122.075 -0.391 . . . . 0.0 110.601 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.412 ' O ' HG23 ' B' ' 749' ' ' VAL . 28.5 mt -54.1 -19.87 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.553 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.547 ' HG3' HD11 ' A' ' 785' ' ' LEU . 3.0 ttt85 -59.85 -29.68 68.45 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.69 -18.67 8.57 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 122.109 -0.37 . . . . 0.0 110.063 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 749' ' ' VAL . . . . . 0.412 HG23 ' O ' ' B' ' 746' ' ' ILE . 43.9 t -56.04 -54.53 26.09 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 177.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -73.07 -22.11 60.66 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.27 174.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.9 -19.84 31.21 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.228 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 6.9 m -58.25 -37.47 74.99 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.799 -0.824 . . . . 0.0 108.968 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.4 tp -66.01 -51.02 62.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.299 0.571 . . . . 0.0 109.757 178.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.37 -36.38 83.83 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.96 -45.0 94.07 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.854 -0.529 . . . . 0.0 111.005 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -65.14 -34.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.711 0.767 . . . . 0.0 109.032 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.5 -30.29 68.11 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.724 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.402 ' OD1' HD22 ' C' ' 715' ' ' LEU . 37.9 m-20 -55.33 -47.96 74.89 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.323 -0.861 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.35 -45.25 66.49 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.105 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.4 mt -66.73 -46.5 75.28 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 761' ' ' ARG . . . . . 0.407 ' O ' ' HA ' ' B' ' 765' ' ' LEU . 26.5 mtm180 -66.65 -22.76 66.1 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 11.8 t -76.82 -45.1 29.9 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.521 0.677 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.856 ' HA ' HD22 ' B' ' 774' ' ' LEU . 5.1 mp -66.77 -54.6 21.11 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -178.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 764' ' ' SER . . . . . 0.554 ' C ' HD12 ' B' ' 765' ' ' LEU . 12.9 p -98.56 -23.39 15.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 765' ' ' LEU . . . . . 0.554 HD12 ' C ' ' B' ' 764' ' ' SER . 5.2 mp 70.37 -66.9 0.26 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 121.731 -0.606 . . . . 0.0 110.996 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -130.22 -67.06 0.75 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.783 -0.573 . . . . 0.0 110.997 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 7.3 m -97.66 146.44 25.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.332 0.587 . . . . 0.0 110.739 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.98 -31.96 70.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.939 0.4 . . . . 0.0 110.599 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -53.67 -39.08 64.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.822 0.82 . . . . 0.0 109.542 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.57 -29.65 64.62 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.279 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.432 ' O ' HD23 ' B' ' 771' ' ' LEU . 5.7 tt -59.5 -43.26 93.38 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -37.27 75.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.67 -48.74 75.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.856 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.1 OUTLIER -58.83 -38.12 77.95 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 121.82 0.819 . . . . 0.0 110.05 178.926 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.693 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -58.28 -36.66 73.62 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 121.784 -0.573 . . . . 0.0 110.507 -179.096 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 776' ' ' LEU . . . . . 0.42 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.32 -31.28 67.23 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 22.5 pt -70.27 -36.69 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 121.471 -0.768 . . . . 0.0 109.792 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 39.2 t -55.53 -46.04 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 121.666 -0.646 . . . . 0.0 111.15 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.42 HG22 ' O ' ' B' ' 776' ' ' LEU . 12.4 t -63.31 -42.67 99.04 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.997 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -37.41 81.54 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.573 -0.705 . . . . 0.0 111.15 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.92 -47.14 94.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 122.05 -0.406 . . . . 0.0 111.32 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.1 -38.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.488 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.17 -46.03 89.45 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.721 0.772 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 31.2 tp -68.7 -40.55 79.98 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.975 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.465 HD23 ' CG ' ' C' ' 750' ' ' ASN . 1.3 tp -78.01 -16.79 57.8 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.98 0.419 . . . . 0.0 111.787 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -49.3 -37.46 24.76 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 -106.12 122.55 46.41 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 122.179 -0.601 . . . . 0.0 110.641 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.67 -179.747 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.82 HD23 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.418 0.628 . . . . 0.0 109.578 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.0 mp -132.13 158.19 42.3 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.391 0.615 . . . . 0.0 111.056 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.66 166.04 2.13 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.664 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.5 tm? -58.37 -48.52 80.35 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.924 0.869 . . . . 0.0 110.089 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.22 -21.82 66.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.52 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -41.44 22.0 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -61.63 -46.45 89.75 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.533 0.682 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.82 -31.91 68.9 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.616 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -57.87 -38.13 75.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.47 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -61.31 -29.31 69.8 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.066 0.46 . . . . 0.0 111.764 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 41.7 m95 -59.53 -28.87 67.46 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.965 -0.46 . . . . 0.0 111.198 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -77.68 -25.1 49.27 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 122.013 -0.43 . . . . 0.0 111.748 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.22 -42.22 90.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.426 0.631 . . . . 0.0 110.579 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.2 t80 53.58 30.97 11.63 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.098 0.475 . . . . 0.0 111.833 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -151.46 -69.85 0.17 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.508 -0.745 . . . . 0.0 112.471 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.62 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -68.31 -37.19 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.474 0.654 . . . . 0.0 111.515 -178.844 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -51.93 -33.72 38.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.462 -178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -57.08 -49.02 77.14 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.628 0.727 . . . . 0.0 109.576 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.604 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.8 t90 -64.78 -44.22 90.68 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 122.004 -0.435 . . . . 0.0 110.416 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.15 -36.1 82.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -98.11 -15.42 19.97 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -98.44 -11.92 21.87 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.329 -0.857 . . . . 0.0 112.295 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.604 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.1 pt -61.06 -36.4 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 121.788 -0.57 . . . . 0.0 110.872 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -53.45 -47.32 69.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.962 0.41 . . . . 0.0 110.132 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.453 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.9 -34.05 67.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.488 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.79 -33.37 71.63 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.335 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.805 HG21 HD12 ' A' ' 686' ' ' ILE . 11.6 mm -60.64 -46.74 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.31 -39.55 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.8 -37.12 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.429 HG23 ' O ' ' C' ' 685' ' ' PHE . 78.4 t -54.38 -39.74 45.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.2 -38.98 80.04 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.3 m -67.41 -38.47 84.68 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 122.237 1.018 . . . . 0.0 109.421 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.0 tp -59.74 -46.17 89.95 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.261 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -67.84 -41.61 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.044 -0.41 . . . . 0.0 111.105 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.692 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.34 -29.85 69.91 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.597 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.4 tt -63.01 -37.6 87.83 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 122.005 0.907 . . . . 0.0 110.25 178.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -55.75 -28.4 55.74 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.692 HG22 ' O ' ' C' ' 694' ' ' GLY . 20.2 tt -58.61 -35.51 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.426 -0.796 . . . . 0.0 111.532 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.597 HG12 ' O ' ' C' ' 695' ' ' LEU . 11.0 p -53.97 -29.94 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.469 -0.769 . . . . 0.0 110.103 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -55.99 -31.5 63.09 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.808 -0.558 . . . . 0.0 110.336 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.47 -37.68 78.84 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.13 -39.28 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.87 -37.22 86.0 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.022 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 52.6 p -62.9 -36.14 82.39 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.761 -0.587 . . . . 0.0 110.621 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -40.49 93.94 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 108.832 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.27 -43.75 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -62.38 -35.66 79.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.364 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -59.52 -51.03 71.61 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.969 0.89 . . . . 0.0 110.355 -178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -45.56 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.925 0.869 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -73.81 -38.09 64.69 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -102.63 -2.52 28.19 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 86.45 -176.13 48.03 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -139.19 -57.96 0.6 Allowed 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.585 -0.95 . . . . 0.0 112.548 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 14.9 p -81.41 149.17 64.63 Favored Pre-proline 0 C--N 1.338 0.103 0 CA-C-O 118.335 -0.84 . . . . 0.0 109.644 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -30.64 94.64 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.429 2.086 . . . . 0.0 112.566 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.402 HD22 ' OD1' ' B' ' 758' ' ' ASP . 0.5 OUTLIER -81.52 16.78 1.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.305 -176.752 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 121.806 0.812 . . . . 0.0 110.34 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 121.66 0.743 . . . . 0.0 111.546 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -72.14 -26.68 62.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.848 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -61.56 -8.26 4.16 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.855 -0.528 . . . . 0.0 112.395 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.542 ' NE ' HD11 ' B' ' 774' ' ' LEU . 63.7 mtm-85 -71.76 -45.27 62.21 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.724 -0.61 . . . . 0.0 111.677 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.4 -38.62 77.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.877 -0.515 . . . . 0.0 109.796 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.12 -42.47 69.18 Favored 'General case' 0 N--CA 1.457 -0.084 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.2 p -58.35 -43.09 88.17 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 122.088 -0.383 . . . . 0.0 110.935 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.3 -21.03 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 O-C-N 121.667 -0.645 . . . . 0.0 109.448 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -59.74 -26.3 65.54 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 109.097 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.482 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.0 OUTLIER -55.5 -24.25 30.48 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.861 0.362 . . . . 0.0 110.104 178.553 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.66 -54.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.35 0.627 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.465 ' CG ' HD23 ' B' ' 785' ' ' LEU . 6.7 m120 -72.3 -24.93 61.4 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.892 0.853 . . . . 0.0 109.19 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.33 -20.75 37.89 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.905 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 1.9 m -58.81 -37.92 77.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.921 0.86 . . . . 0.0 109.775 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 19.1 tp -67.04 -51.42 55.0 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.479 0.657 . . . . 0.0 109.935 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 754' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.93 -34.84 78.88 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.413 0.625 . . . . 0.0 111.828 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.36 -45.11 92.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.101 0.477 . . . . 0.0 110.867 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.04 -34.83 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.517 0.675 . . . . 0.0 109.427 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.26 -30.76 68.94 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -55.76 -49.07 74.11 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 121.033 -1.042 . . . . 0.0 109.987 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -70.47 -44.77 67.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.448 0.642 . . . . 0.0 111.648 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -40.92 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -78.85 -35.57 43.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 15.4 p -64.54 -45.39 87.38 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.628 -0.67 . . . . 0.0 111.276 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -55.79 10.85 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.1 m -99.28 -49.53 4.43 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.419 -0.801 . . . . 0.0 112.67 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 8.7 tp 80.31 106.26 0.07 Allowed 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.884 0.849 . . . . 0.0 110.348 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 70.65 -68.26 0.22 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.64 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 3.3 m -144.47 179.66 7.12 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.356 0.598 . . . . 0.0 111.518 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.5 -162.32 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 11.1 t60 75.78 -59.81 0.51 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -61.96 -30.2 70.76 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.568 177.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.77 -32.59 70.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -35.09 68.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -69.45 -34.47 74.46 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.579 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.3 OUTLIER -58.74 -38.04 77.52 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.004 178.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.99 -37.01 73.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.648 0.737 . . . . 0.0 109.666 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.12 -38.99 60.88 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.643 0.735 . . . . 0.0 109.584 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.566 HG22 ' CD1' ' C' ' 781' ' ' ILE . 82.7 mt -59.06 -45.47 92.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.853 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 31.1 m -58.54 -44.11 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.313 -0.867 . . . . 0.0 111.42 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.419 ' O ' HG22 ' C' ' 782' ' ' VAL . 82.3 p -63.89 -46.19 85.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -31.76 72.11 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.133 0.492 . . . . 0.0 111.576 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.762 HG21 ' HB ' ' A' ' 746' ' ' ILE . 58.7 mt -63.89 -47.1 92.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.24 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.419 HG22 ' O ' ' C' ' 779' ' ' THR . 33.1 m -54.09 -37.89 36.46 Favored 'Isoleucine or valine' 0 C--N 1.35 0.625 0 CA-C-N 119.72 1.145 . . . . 0.0 110.047 -177.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -65.35 -46.38 80.45 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.413 0.625 . . . . 0.0 110.767 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 52.9 tp -70.52 -44.94 66.54 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.858 HD22 ' HA ' ' A' ' 744' ' ' ARG . 27.7 tp -88.08 -10.99 48.41 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.552 -0.717 . . . . 0.0 110.987 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.62 -33.48 4.66 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 121.8 -0.563 . . . . 0.0 111.988 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.26 107.41 14.38 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.995 -0.709 . . . . 0.0 109.486 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 117.921 -1.037 . . . . 0.0 110.734 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt -177.08 101.52 0.05 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.543 0.687 . . . . 0.0 109.676 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -173.65 -169.17 0.48 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.165 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.4 tt -48.02 -39.53 20.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.379 0.609 . . . . 0.0 110.821 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.48 -37.08 71.34 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -41.73 51.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.558 0.694 . . . . 0.0 110.739 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -75.15 -45.76 38.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.842 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.17 -35.28 76.13 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.021 0.439 . . . . 0.0 111.907 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.0 m -64.17 -31.03 72.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.526 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.418 HD23 HG23 ' A' ' 676' ' ' THR . 12.4 tp -63.42 -31.14 72.22 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.977 -0.452 . . . . 0.0 111.698 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -59.73 -29.84 68.41 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.778 -0.576 . . . . 0.0 111.08 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -25.57 68.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.183 0.516 . . . . 0.0 111.168 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -60.99 -40.54 93.86 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.59 0.71 . . . . 0.0 110.278 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 23.8 t80 56.34 35.01 25.15 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.559 0.695 . . . . 0.0 111.235 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -155.41 -64.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.714 -0.617 . . . . 0.0 111.649 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 679' ' ' LEU . 8.1 tp -68.22 -37.28 77.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 122.061 -0.399 . . . . 0.0 111.568 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.418 HG23 HD23 ' A' ' 669' ' ' LEU . 5.0 m -52.56 -33.69 46.91 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 122.095 -0.378 . . . . 0.0 111.727 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -65.88 -49.76 66.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.299 0.571 . . . . 0.0 110.686 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.4 t90 -65.26 -44.6 87.57 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.509 0.671 . . . . 0.0 109.352 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 675' ' ' ILE . 3.2 mm? -65.35 -35.61 81.48 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.964 -0.46 . . . . 0.0 111.729 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -93.28 -14.97 26.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -93.37 -12.95 28.73 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.608 -0.682 . . . . 0.0 111.787 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.1 pp -60.79 -36.57 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 O-C-N 121.872 -0.517 . . . . 0.0 110.442 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.474 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.3 ttt-85 -53.77 -47.43 70.74 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.613 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.498 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -73.84 -35.12 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.421 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.4 OUTLIER -58.75 -27.78 65.26 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.612 -177.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.964 HG21 HD12 ' B' ' 686' ' ' ILE . 14.9 mm -60.88 -42.09 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 121.513 0.673 . . . . 0.0 109.247 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 77.2 mt -71.04 -36.75 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.072 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 684' ' ' ILE . 30.8 mm -58.6 -37.31 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 O-C-N 122.043 -0.411 . . . . 0.0 109.996 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 685' ' ' PHE . 98.8 t -54.44 -42.01 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.76 -41.51 66.46 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -65.92 -38.71 89.39 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.834 0.826 . . . . 0.0 109.714 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -45.86 91.16 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.947 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.808 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -67.76 -42.0 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.785 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.42 -24.57 61.74 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.563 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -60.47 -39.22 86.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.014 0.911 . . . . 0.0 109.459 178.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 17.6 mmt180 -56.22 -28.44 58.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.889 0.875 . . . . 0.0 112.812 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.1 -37.21 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 O-C-N 121.17 -0.956 . . . . 0.0 108.67 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.733 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.8 p -67.69 -30.65 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 O-C-N 121.533 -0.729 . . . . 0.0 110.239 176.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.89 -28.99 59.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.071 0.463 . . . . 0.0 110.405 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.47 -37.0 72.2 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.0 m -63.58 -35.99 74.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 119.938 -0.705 . . . . 0.0 109.552 178.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.8 tp -61.01 -42.3 98.2 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.013 -0.429 . . . . 0.0 110.753 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 60.9 p -62.94 -35.02 78.72 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.371 0.605 . . . . 0.0 110.072 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.44 96.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 122.113 0.958 . . . . 0.0 108.852 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 701' ' ' VAL . 98.6 t -65.39 -45.11 94.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.029 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -62.91 -36.82 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.914 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.425 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 8.3 ttm180 -60.59 -47.5 85.94 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.43 0.633 . . . . 0.0 110.612 -178.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 748' ' ' LEU . 1.2 t -75.02 -44.37 44.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 122.188 0.995 . . . . 0.0 108.58 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -66.11 -18.71 65.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.973 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -97.22 -18.82 19.0 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.384 -0.823 . . . . 0.0 112.841 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 116.66 11.27 9.53 Favored Glycine 0 CA--C 1.54 1.601 0 O-C-N 121.385 -0.822 . . . . 0.0 112.751 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.455 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 63.32 -121.08 0.56 Allowed 'General case' 0 CA--C 1.565 1.521 0 O-C-N 121.935 -0.744 . . . . 0.0 111.053 179.322 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.455 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 69.7 p -62.77 159.35 45.22 Favored Pre-proline 0 C--N 1.351 0.672 0 O-C-N 120.84 -1.163 . . . . 0.0 111.519 -178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.485 ' HD2' HG21 ' C' ' 708' ' ' VAL . 83.0 Cg_exo -43.67 113.72 0.43 Allowed 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 121.758 1.639 . . . . 0.0 111.758 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.12 -20.27 13.06 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.483 1.225 0 CA-C-O 122.669 1.223 . . . . 0.0 110.876 -179.037 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 122.18 0.99 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 12.4 mtt-85 -58.03 -25.47 61.2 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.759 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -10.8 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.502 ' O ' HD12 ' A' ' 746' ' ' ILE . 7.1 mtm105 -70.71 -46.18 63.56 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.45 -0.782 . . . . 0.0 109.196 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -59.07 -46.1 89.14 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.191 0.52 . . . . 0.0 111.962 -178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 744' ' ' ARG . . . . . 0.679 ' O ' HD22 ' C' ' 785' ' ' LEU . 0.5 OUTLIER -72.41 -28.61 63.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.57 0.7 . . . . 0.0 111.67 179.537 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 12.2 p -69.51 -36.46 76.47 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.011 -1.056 . . . . 0.0 111.726 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.9 mp -66.61 -46.79 85.2 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 CA-C-O 117.058 -1.449 . . . . 0.0 114.0 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.717 ' CB ' HD23 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -80.45 -13.09 59.41 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 122.715 2.507 . . . . 0.0 109.453 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.631 HD13 ' HG3' ' B' ' 714' ' ' PRO . 56.5 tp -60.1 -17.23 38.4 Favored 'General case' 0 C--N 1.363 1.187 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 172.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.3 p -57.63 -44.82 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -70.9 -13.19 61.93 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 122.116 0.96 . . . . 0.0 109.447 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.11 -18.95 21.66 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 124.167 0.889 . . . . 0.0 111.329 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 70.6 p -57.38 -37.3 72.45 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 117.645 0.722 . . . . 0.0 109.06 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.93 -51.05 69.67 Favored 'General case' 0 C--N 1.346 0.414 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.86 -35.25 72.66 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.892 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.3 -44.99 92.49 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -61.71 -36.21 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.02 -30.56 70.68 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.625 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.533 ' OD1' HD22 ' B' ' 715' ' ' LEU . 13.2 m-20 -56.09 -50.15 71.83 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.407 -0.808 . . . . 0.0 109.154 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -71.49 -45.15 63.27 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.686 0.755 . . . . 0.0 111.624 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.457 ' O ' HD23 ' A' ' 760' ' ' LEU . 1.4 tt -61.53 -38.99 89.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.652 0.739 . . . . 0.0 112.359 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 13.5 ttm105 -82.59 -17.98 42.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 15.9 p -76.23 -46.16 29.48 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.481 -0.762 . . . . 0.0 112.706 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -68.6 -54.37 16.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.19 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 5.1 t -97.86 -49.51 4.78 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.039 0.923 . . . . 0.0 111.556 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 765' ' ' LEU . 7.9 tt 75.77 -71.3 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.298 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -108.4 -66.31 1.05 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.724 -0.61 . . . . 0.0 111.238 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 2.0 t -104.92 134.3 48.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.076 0.465 . . . . 0.0 110.476 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.451 ' CZ ' HD13 ' A' ' 771' ' ' LEU . 2.8 t80 -55.27 -21.63 15.25 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.981 0.419 . . . . 0.0 110.821 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -60.5 -39.92 89.46 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-O 121.726 0.774 . . . . 0.0 109.24 178.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -55.69 -29.5 59.52 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.837 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.501 HD11 HD22 ' A' ' 763' ' ' LEU . 9.2 tt -59.44 -34.77 72.92 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 122.157 -0.339 . . . . 0.0 110.606 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -56.88 -32.92 66.35 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -66.13 -46.84 76.13 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.572 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.5 tp -58.91 -38.65 79.4 Favored 'General case' 0 C--N 1.354 0.782 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.441 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 775' ' ' LEU . . . . . 0.446 ' O ' HD23 ' A' ' 775' ' ' LEU . 7.5 tt -63.38 -42.6 98.83 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.692 -0.63 . . . . 0.0 111.791 -178.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 43.9 mt -74.57 -39.64 62.13 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.71 -37.44 77.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.427 -178.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 18.4 m -60.4 -42.86 92.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.571 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.028 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.808 ' O ' HG22 ' A' ' 782' ' ' VAL . 24.2 p -63.79 -44.67 92.68 Favored 'General case' 0 C--N 1.343 0.303 0 O-C-N 122.042 -0.412 . . . . 0.0 111.768 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -33.69 76.13 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.44 ' HB ' HG21 ' B' ' 746' ' ' ILE . 60.6 mt -54.97 -37.1 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 O-C-N 121.911 -0.493 . . . . 0.0 110.663 -179.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 779' ' ' THR . 14.6 m -54.76 -38.15 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 O-C-N 121.209 -0.932 . . . . 0.0 109.69 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.16 -45.36 92.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.555 0.693 . . . . 0.0 110.753 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.89 -43.88 86.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.236 0.541 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.417 HD21 ' HG2' ' B' ' 747' ' ' ARG . 0.4 OUTLIER -74.62 -22.5 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.921 0.391 . . . . 0.0 111.509 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.07 -38.09 5.98 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -108.92 121.86 46.01 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.56 0.695 . . . . 0.0 110.485 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.593 -179.843 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.461 ' O ' HD22 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 120.457 0.17 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.461 HD22 ' O ' ' B' ' 660' ' ' LEU . 0.0 OUTLIER 176.53 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -176.01 -179.35 1.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.634 0.731 . . . . 0.0 110.924 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.51 HD12 ' HG ' ' C' ' 660' ' ' LEU . 0.5 OUTLIER -56.58 -39.05 72.84 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.498 0.666 . . . . 0.0 109.837 179.474 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.12 -34.22 77.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.344 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -75.22 -47.12 29.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.087 0.47 . . . . 0.0 110.379 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.424 ' HE1' HD12 ' B' ' 661' ' ' LEU . 82.6 m95 -68.24 -46.0 71.69 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.501 0.667 . . . . 0.0 111.439 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.64 -19.21 65.82 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.045 -178.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.8 66.24 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.063 -0.398 . . . . 0.0 111.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.443 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -60.78 -36.32 78.68 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -59.9 -17.26 35.83 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.846 -0.534 . . . . 0.0 111.239 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -27.17 24.79 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.16 0.505 . . . . 0.0 110.205 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -64.04 -46.62 83.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.545 0.688 . . . . 0.0 110.431 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 21.0 t80 57.65 31.84 20.97 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.517 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -142.93 -70.41 0.33 Allowed 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.719 -0.613 . . . . 0.0 110.907 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.95 -37.5 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.05 -0.406 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.5 -33.87 46.92 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -65.67 -50.32 65.37 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.712 -0.617 . . . . 0.0 110.701 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.686 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.8 t90 -65.76 -42.45 90.88 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 122.017 0.913 . . . . 0.0 109.76 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -39.17 93.8 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.14 -178.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -97.15 -28.2 14.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -77.11 -15.59 59.5 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.468 -0.77 . . . . 0.0 111.901 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.686 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.9 pt -60.78 -37.35 75.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.894 -0.504 . . . . 0.0 111.006 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -53.66 -47.35 70.45 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.912 0.387 . . . . 0.0 110.805 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.495 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -70.64 -35.17 59.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.97 -27.89 67.2 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.205 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.964 HD12 HG21 ' A' ' 686' ' ' ILE . 18.1 mm -60.62 -48.2 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 O-C-N 121.827 -0.546 . . . . 0.0 109.789 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -64.88 -41.1 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.99 -38.06 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.22 -44.3 98.94 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.18 -26.7 9.5 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 13.7 m -60.52 -46.11 91.37 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.541 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.82 -32.89 71.07 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.364 -0.835 . . . . 0.0 112.504 -177.558 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.541 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -58.99 -47.02 91.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.96 -27.21 66.66 Favored Glycine 0 CA--C 1.541 1.699 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.565 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -59.33 -37.25 77.34 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.04 0.924 . . . . 0.0 110.089 179.455 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.808 ' HE ' HD11 ' A' ' 693' ' ' ILE . 12.8 mmt180 -55.39 -27.85 50.3 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -179.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.74 -36.86 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 O-C-N 121.028 -1.045 . . . . 0.0 109.01 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.565 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.6 p -67.41 -30.69 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 O-C-N 121.722 -0.611 . . . . 0.0 110.327 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.0 m-85 -56.49 -31.26 63.89 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.871 -0.518 . . . . 0.0 110.153 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.61 78.7 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -37.73 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.665 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.5 tp -56.86 -37.92 71.99 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.761 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 51.0 m -62.83 -36.15 82.25 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.18 0.514 . . . . 0.0 110.837 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -44.85 90.34 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 122.238 1.018 . . . . 0.0 108.826 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.691 HG22 HD13 ' B' ' 748' ' ' LEU . 76.9 t -65.36 -45.14 94.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 122.522 1.153 . . . . 0.0 109.211 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -62.69 -35.87 81.08 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.557 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -65.74 -49.41 68.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.488 0.661 . . . . 0.0 112.323 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -44.17 31.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.25 -45.35 91.43 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -175.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.43 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 2.4 pt20 -104.67 -24.56 12.94 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.67 177.31 14.84 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -113.43 -62.68 1.56 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.736 -0.861 . . . . 0.0 112.804 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 8.4 p -62.76 159.3 45.5 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.388 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.631 ' HG3' HD13 ' A' ' 748' ' ' LEU . 86.5 Cg_exo -29.81 108.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 122.76 2.307 . . . . 0.0 112.961 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.533 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.9 tt -67.02 -16.72 64.54 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 121.763 0.792 . . . . 0.0 109.547 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.488 0.661 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -58.6 -26.86 64.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.167 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -55.72 -12.28 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -68.41 -40.97 81.08 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.563 -0.711 . . . . 0.0 111.567 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -58.5 -41.14 84.69 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.506 -0.746 . . . . 0.0 110.664 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.26 -36.96 71.95 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.244 0.545 . . . . 0.0 110.021 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 8.9 p -56.96 -46.22 82.31 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 122.056 -0.402 . . . . 0.0 110.44 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.44 HG21 ' HB ' ' A' ' 781' ' ' ILE . 1.8 mp -53.34 -19.22 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.081 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.417 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.0 OUTLIER -59.39 -28.13 66.61 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.126 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.691 HD13 HG22 ' B' ' 705' ' ' VAL . 4.2 pp -55.61 -21.29 16.94 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.941 0.401 . . . . 0.0 110.374 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 48.4 t -55.61 -53.95 31.11 Favored 'Isoleucine or valine' 0 C--N 1.35 0.596 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -72.61 -22.66 60.93 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.689 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.23 -20.68 36.85 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.999 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 18.4 m -59.5 -38.97 82.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 117.884 0.842 . . . . 0.0 109.631 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 16.9 tp -67.89 -51.18 51.0 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.436 0.636 . . . . 0.0 109.995 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.55 81.0 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.3 0.571 . . . . 0.0 111.513 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 5.7 tt -60.81 -45.49 94.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.903 0.382 . . . . 0.0 111.618 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 54.8 mt -65.64 -37.32 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 121.654 0.74 . . . . 0.0 109.229 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.13 -30.06 68.24 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.673 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.509 ' OD1' HD22 ' C' ' 715' ' ' LEU . 82.7 m-20 -55.35 -46.91 76.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.531 -0.731 . . . . 0.0 109.767 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.36 -45.23 66.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-O 121.063 0.458 . . . . 0.0 112.166 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 43.4 mt -69.2 -45.35 70.13 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.475 0.655 . . . . 0.0 112.748 -178.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -60.86 -43.19 98.7 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.8 m -59.69 -42.97 94.16 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.413 -0.805 . . . . 0.0 111.323 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -68.0 -54.23 20.01 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.584 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.81 -48.11 5.32 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.653 0.739 . . . . 0.0 112.051 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 78.21 -54.74 0.49 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.654 0.782 . . . . 0.0 111.343 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -137.51 119.46 15.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 111.236 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 16.7 m 54.02 177.3 0.02 OUTLIER 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.147 0.499 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 768' ' ' TYR . . . . . 0.461 ' CD1' HD13 ' B' ' 771' ' ' LEU . 4.9 m-85 -97.49 -2.11 42.67 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.958 -0.464 . . . . 0.0 111.621 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -74.3 -43.15 57.99 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -62.24 -29.96 70.76 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.262 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' B' ' 768' ' ' TYR . 0.2 OUTLIER -59.79 -31.08 69.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -56.94 -35.61 69.28 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.466 0.651 . . . . 0.0 109.425 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -69.02 -34.93 76.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.311 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.502 HD13 ' HG ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.45 -37.95 76.51 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.023 0.439 . . . . 0.0 110.576 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.34 -36.54 73.58 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 0.0 111.65 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.35 -48.09 71.37 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.775 -0.578 . . . . 0.0 111.623 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 17.4 pt -56.35 -34.94 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 O-C-N 122.004 -0.435 . . . . 0.0 110.4 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.432 ' HA ' HG12 ' B' ' 781' ' ' ILE . 56.2 t -53.44 -43.16 51.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -178.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.06 -36.49 84.18 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.75 0.786 . . . . 0.0 110.22 177.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -63.33 -36.43 83.65 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.155 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.968 HG23 HG23 ' C' ' 746' ' ' ILE . 3.7 mm -54.79 -55.45 15.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 O-C-N 122.11 -0.369 . . . . 0.0 110.933 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 31.3 m -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.39 0.614 . . . . 0.0 110.355 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.98 -42.05 99.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.196 0.522 . . . . 0.0 111.474 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 12.1 tp -68.66 -39.43 80.64 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.956 0.884 . . . . 0.0 110.226 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.677 HD12 ' O ' ' B' ' 781' ' ' ILE . 0.8 OUTLIER -76.99 -23.0 52.29 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.459 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.58 -54.62 8.74 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.32 125.4 37.9 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.402 0.62 . . . . 0.0 110.323 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.632 -179.474 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.641 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.385 0.612 . . . . 0.0 110.016 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.517 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.1 mp 56.84 102.71 0.02 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 121.587 0.708 . . . . 0.0 110.585 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -164.13 171.07 15.57 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.717 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.466 HD23 ' C ' ' C' ' 663' ' ' LEU . 10.5 tt -51.93 -61.93 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.588 0.708 . . . . 0.0 110.853 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.81 -16.61 63.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.279 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -81.22 -46.15 15.25 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 122.06 -0.4 . . . . 0.0 111.194 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -64.84 -45.98 83.82 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.667 0.746 . . . . 0.0 110.013 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.32 -21.21 66.25 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.431 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 48.4 t -69.63 -29.69 67.24 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.884 -0.51 . . . . 0.0 111.483 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' C' ' 669' ' ' LEU . 4.4 mm? -59.85 -37.66 79.91 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.129 0.49 . . . . 0.0 110.795 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -59.87 -18.94 48.29 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 111.297 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -81.21 -28.33 34.94 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.425 0.631 . . . . 0.0 110.777 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -60.05 -46.51 89.3 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.586 0.708 . . . . 0.0 110.209 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.23 36.62 27.62 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.428 0.632 . . . . 0.0 111.66 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.6 -73.36 0.14 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.734 -0.604 . . . . 0.0 111.772 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.688 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.1 -37.33 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.366 0.603 . . . . 0.0 111.608 -178.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.76 -33.72 36.23 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.918 -0.488 . . . . 0.0 111.983 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -60.63 -50.19 74.52 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.721 -0.612 . . . . 0.0 109.665 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.5 t90 -65.67 -40.08 92.02 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 121.761 0.791 . . . . 0.0 109.815 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.548 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -65.44 -35.78 81.93 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.251 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -104.91 -20.52 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -176.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -86.97 -12.94 46.04 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.48 -0.763 . . . . 0.0 112.159 -179.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.1 pp -60.75 -36.35 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 122.033 -0.417 . . . . 0.0 110.329 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.499 ' N ' HD12 ' C' ' 682' ' ' ILE . 8.4 ttt-85 -53.9 -47.1 71.48 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.934 0.397 . . . . 0.0 110.467 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.445 HG22 HD12 ' C' ' 688' ' ' ILE . 1.7 mp -66.34 -36.35 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.676 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.8 -33.73 72.12 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.955 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.77 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.95 -52.01 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.074 0.464 . . . . 0.0 110.083 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 61.3 mt -62.84 -37.07 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 121.709 0.766 . . . . 0.0 108.934 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.445 HD12 HG22 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -58.82 -37.57 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.676 HG23 ' O ' ' C' ' 685' ' ' PHE . 61.7 t -55.16 -40.03 53.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 690' ' ' GLY . . . . . 0.417 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.65 -39.49 75.86 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -67.66 -38.77 84.23 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.976 0.893 . . . . 0.0 109.384 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -46.33 90.2 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.224 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.533 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.3 pp -65.27 -41.91 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 121.353 0.596 . . . . 0.0 109.848 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.556 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.76 -25.9 64.3 Favored Glycine 0 CA--C 1.539 1.588 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.42 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.4 tt -58.38 -37.8 75.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.723 0.773 . . . . 0.0 110.271 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -55.44 -28.71 56.02 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.556 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.79 -36.44 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 120.874 -1.141 . . . . 0.0 111.804 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.42 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -59.1 -30.39 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.271 -0.893 . . . . 0.0 110.19 178.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -56.41 -30.71 63.11 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.839 -0.538 . . . . 0.0 110.18 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.81 -37.78 77.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -44.33 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.97 -36.95 75.7 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.72 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 66.6 m -62.05 -37.26 84.29 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -40.91 95.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 122.0 0.905 . . . . 0.0 108.779 178.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.528 HG13 HD13 ' C' ' 748' ' ' LEU . 96.7 t -65.69 -44.98 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.693 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -62.79 -36.29 82.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.49 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.58 -48.69 78.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.8 0.81 . . . . 0.0 110.296 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.485 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -76.0 -43.96 38.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.978 -178.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 709' ' ' ARG . . . . . 0.414 ' HB2' HD22 ' C' ' 748' ' ' LEU . 4.5 tmm_? -73.07 -36.23 66.82 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.482 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -102.48 -7.66 21.72 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 99.83 166.29 29.34 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -110.83 -63.0 1.45 Allowed 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.715 -0.874 . . . . 0.0 111.681 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 76.3 p -90.57 159.62 40.73 Favored Pre-proline 0 C--O 1.234 0.273 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.209 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_exo -38.93 119.32 0.43 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.561 1.508 . . . . 0.0 111.801 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.509 HD22 ' OD1' ' B' ' 758' ' ' ASP . 3.0 tt -96.47 4.52 52.05 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -175.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.928 0.87 . . . . 0.0 112.047 -179.449 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 . . . . . 0 C--O 1.234 0.274 0 CA-C-O 122.172 0.987 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -65.67 -26.71 67.91 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.584 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -55.98 -15.21 3.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.495 ' O ' HD12 ' C' ' 746' ' ' ILE . 45.6 mtm-85 -56.06 -33.45 65.02 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.82 -0.55 . . . . 0.0 110.8 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -58.28 -40.25 81.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.618 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -47.83 54.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.058 0.456 . . . . 0.0 110.455 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 745' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' C' ' 742' ' ' ARG . 2.3 p -57.01 -34.88 68.6 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.968 HG23 HG23 ' B' ' 781' ' ' ILE . 0.3 OUTLIER -52.85 -23.23 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 O-C-N 121.658 -0.651 . . . . 0.0 109.856 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -60.18 -24.35 64.69 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.553 0.692 . . . . 0.0 110.069 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.528 HD13 HG13 ' C' ' 705' ' ' VAL . 3.0 pp -61.37 -26.34 67.77 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.904 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 82.3 t -55.81 -53.91 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.614 ' CG ' HD22 ' B' ' 785' ' ' LEU . 9.5 m120 -72.69 -22.84 60.84 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.588 175.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -22.88 46.66 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.906 -177.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 38.1 t -61.2 -41.2 96.41 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.832 -0.805 . . . . 0.0 109.543 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.9 tp -68.12 -46.23 71.48 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 109.938 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.98 -35.56 81.1 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.689 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.483 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.2 tt -60.0 -45.43 92.76 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.268 0.556 . . . . 0.0 110.72 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 45.5 mm -67.43 -40.95 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.138 0.97 . . . . 0.0 108.723 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.44 -30.34 71.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.529 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -55.24 -44.0 75.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.552 -0.717 . . . . 0.0 110.892 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.13 -45.12 67.5 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.309 0.576 . . . . 0.0 110.891 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 26.9 mt -67.26 -40.22 86.2 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -67.29 -50.63 59.55 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 1.3 m -68.35 -43.3 77.74 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.228 1.013 . . . . 0.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.55 -52.68 56.41 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.96 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.79 -34.02 11.04 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.127 -0.983 . . . . 0.0 113.418 -177.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.03 177.25 0.24 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -38.14 -66.3 0.27 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 30.9 m -97.17 162.01 13.55 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.853 -0.529 . . . . 0.0 110.649 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.29 -29.7 62.9 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.839 0.352 . . . . 0.0 110.676 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -53.83 -32.04 51.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.815 0.817 . . . . 0.0 109.471 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 -69.91 -30.54 67.97 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.04 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.4 -43.39 96.73 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -56.78 -36.97 70.47 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.494 0.664 . . . . 0.0 109.428 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -69.17 -39.42 78.75 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.23 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.411 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -65.12 -38.11 89.61 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 121.087 0.47 . . . . 0.0 110.855 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.429 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.7 mp -58.4 -37.79 76.02 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.269 0.557 . . . . 0.0 110.256 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 57.4 mt -74.81 -36.72 62.45 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.486 0.66 . . . . 0.0 110.06 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.445 HG22 ' CD1' ' C' ' 781' ' ' ILE . 40.2 mt -61.26 -47.88 91.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.719 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.446 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -56.06 -39.33 57.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 O-C-N 121.641 -0.662 . . . . 0.0 111.182 -178.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.685 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.2 m -61.01 -47.95 84.08 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.402 -0.811 . . . . 0.0 110.978 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -68.23 -36.53 79.64 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.809 -0.557 . . . . 0.0 111.535 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.445 ' CD1' HG22 ' C' ' 777' ' ' ILE . 72.9 mt -54.93 -38.23 44.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 CA-C-O 118.644 -0.693 . . . . 0.0 111.954 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.685 HG22 ' O ' ' C' ' 779' ' ' THR . 14.2 m -53.2 -36.79 26.26 Favored 'Isoleucine or valine' 0 C--N 1.354 0.787 0 CA-C-N 120.169 1.35 . . . . 0.0 109.092 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -64.27 -41.62 96.83 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.344 -0.848 . . . . 0.0 110.688 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.94 -44.38 69.69 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.717 HD23 ' CB ' ' A' ' 747' ' ' ARG . 21.3 tp -79.53 -26.92 41.36 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.273 -0.892 . . . . 0.0 109.771 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -48.65 -33.7 12.96 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -102.48 129.21 48.93 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.255 0.55 . . . . 0.0 109.887 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.506 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.525 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 37.4 mt 61.46 113.23 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.598 0.713 . . . . 0.0 110.306 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -177.55 179.11 0.96 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.75 -41.81 67.51 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.365 0.603 . . . . 0.0 110.367 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -73.71 -32.87 64.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -78.01 -44.36 26.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.135 0.493 . . . . 0.0 111.199 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -65.04 -45.3 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.189 0.518 . . . . 0.0 110.475 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.35 -20.91 65.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.223 0.535 . . . . 0.0 111.362 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 668' ' ' SER . . . . . 0.401 ' O ' ' ND2' ' A' ' 671' ' ' ASN . 3.8 t -65.17 -39.4 92.88 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.0 mm? -59.89 -27.69 66.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.039 0.447 . . . . 0.0 111.873 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.0 m95 -60.18 -24.6 64.9 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.822 -0.549 . . . . 0.0 112.132 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 671' ' ' ASN . . . . . 0.401 ' ND2' ' O ' ' A' ' 668' ' ' SER . 0.8 OUTLIER -86.61 -15.59 39.3 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.651 -0.655 . . . . 0.0 111.861 179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -65.66 -45.98 80.89 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.497 0.665 . . . . 0.0 110.378 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 45.9 t80 58.42 42.49 21.16 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -161.02 -69.28 0.06 Allowed 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.653 -0.654 . . . . 0.0 111.733 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.33 -36.7 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 122.095 -0.378 . . . . 0.0 111.923 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 6.9 m -52.04 -34.5 43.6 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -65.83 -50.07 65.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.381 0.61 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -65.72 -44.13 86.99 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.698 0.761 . . . . 0.0 110.345 178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -36.0 82.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -95.51 -42.82 8.26 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -70.69 -3.71 19.9 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.557 -0.715 . . . . 0.0 112.755 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.732 HD12 ' H ' ' A' ' 683' ' ' ARG . 1.1 pp -60.91 -36.66 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.672 -0.642 . . . . 0.0 110.038 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.732 ' H ' HD12 ' A' ' 682' ' ' ILE . 9.7 ttt-85 -56.99 -47.13 81.53 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.177 0.513 . . . . 0.0 110.478 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.462 ' O ' HD13 ' A' ' 688' ' ' ILE . 1.8 mp -70.59 -33.2 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -28.48 69.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.584 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 17.0 mm -60.95 -48.07 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.292 0.568 . . . . 0.0 109.656 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 80.1 mt -60.36 -36.94 72.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.462 HD13 ' O ' ' A' ' 684' ' ' ILE . 1.4 mp -60.09 -38.35 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -55.21 -40.86 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.88 -33.27 77.74 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -66.73 -38.71 87.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.95 0.881 . . . . 0.0 110.998 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -46.03 90.69 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -61.43 -41.65 90.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 O-C-N 121.716 -0.615 . . . . 0.0 109.764 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.22 -39.76 97.62 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 178.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.478 ' O ' HG12 ' A' ' 698' ' ' VAL . 4.3 tt -62.43 -40.37 96.35 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.869 0.842 . . . . 0.0 109.7 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.711 ' HE ' HD11 ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.95 -28.08 55.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.66 0.784 . . . . 0.0 112.188 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.9 -34.8 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.551 -0.718 . . . . 0.0 109.41 -177.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.761 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.1 p -53.81 -29.1 17.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 O-C-N 121.534 -0.729 . . . . 0.0 110.307 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -54.77 -28.68 50.53 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.808 -0.558 . . . . 0.0 110.504 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -36.57 70.19 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.3 m -61.29 -35.83 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 CA-C-O 121.674 0.75 . . . . 0.0 109.474 177.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.74 -41.95 96.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.11 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 56.3 p -62.48 -31.92 72.74 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.641 0.734 . . . . 0.0 109.679 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.512 HD22 HH12 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.48 -47.14 87.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.662 1.22 . . . . 0.0 108.667 177.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.415 ' CG2' HD12 ' A' ' 748' ' ' LEU . 80.7 t -64.63 -45.15 96.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.363 -1.289 . . . . 0.0 109.29 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 706' ' ' ASN . . . . . 0.53 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 7.8 m120 -62.31 -36.98 83.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.512 HH12 HD22 ' A' ' 704' ' ' LEU . 38.3 ttm105 -57.57 -48.46 79.29 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.725 -1.235 . . . . 0.0 110.083 -179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.5 t -76.42 -44.45 35.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.404 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.98 -16.03 61.08 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 710' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 1.8 tt0 -101.26 -8.45 22.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.031 -1.043 . . . . 0.0 113.468 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.38 18.1 10.68 Favored Glycine 0 CA--C 1.541 1.664 0 O-C-N 121.824 -0.548 . . . . 0.0 112.55 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.417 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.3 OUTLIER 54.13 -125.03 2.27 Favored 'General case' 0 CA--C 1.566 1.567 0 O-C-N 121.831 -0.805 . . . . 0.0 110.243 179.281 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.417 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 0.3 OUTLIER -62.13 159.71 36.4 Favored Pre-proline 0 C--N 1.353 0.734 0 O-C-N 120.754 -1.216 . . . . 0.0 109.689 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -45.4 104.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 121.177 1.251 . . . . 0.0 111.56 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.24 -20.33 16.65 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -177.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.549 0.909 0 CA-C-O 122.24 1.019 . . . . 0.0 111.052 -179.769 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.708 0.766 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -57.84 -25.28 60.47 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.001 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -12.33 0.68 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -177.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -42.26 89.18 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.479 -0.763 . . . . 0.0 109.021 177.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' C' ' 781' ' ' ILE . 19.5 m-20 -64.91 -36.1 83.27 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -36.67 77.05 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.69 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.5 p -63.76 -45.3 90.46 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.66 HD12 ' CD1' ' C' ' 781' ' ' ILE . 40.7 mt -55.32 -21.11 8.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.973 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.544 ' NH1' HG22 ' C' ' 781' ' ' ILE . 1.9 mmp_? -59.86 -30.48 69.0 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.629 -0.669 . . . . 0.0 109.201 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.837 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -62.07 -16.69 53.96 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.167 0.508 . . . . 0.0 110.315 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.57 -55.12 16.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.885 0 O-C-N 120.96 -1.088 . . . . 0.0 108.123 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.435 ' CG ' HD23 ' C' ' 785' ' ' LEU . 8.6 m120 -72.96 -22.0 60.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 122.507 1.146 . . . . 0.0 108.953 174.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.45 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.72 -19.65 29.1 Favored Glycine 0 C--O 1.219 -0.843 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.211 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 88.3 p -57.98 -37.65 74.62 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.046 0.923 . . . . 0.0 109.065 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.2 tp -66.64 -51.1 60.02 Favored 'General case' 0 C--N 1.343 0.294 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.41 73.38 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.087 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.0 tt -58.67 -45.07 90.21 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.931 -0.481 . . . . 0.0 111.696 -176.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.73 -34.2 61.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.7 -29.48 66.9 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.941 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 20.2 m-20 -54.6 -49.02 71.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.324 -0.86 . . . . 0.0 109.686 -177.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.68 -44.93 65.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.527 0.679 . . . . 0.0 111.327 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 3.6 mt -65.74 -29.79 70.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 70.7 mtt180 -73.59 -27.79 61.48 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -45.74 39.43 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.368 -0.832 . . . . 0.0 110.446 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.706 ' HA ' HD22 ' A' ' 774' ' ' LEU . 6.3 mp -68.96 -54.94 12.62 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 -49.19 4.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.612 0.72 . . . . 0.0 111.785 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.422 ' C ' HD23 ' A' ' 765' ' ' LEU . 4.5 tt 79.21 -66.9 0.17 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.432 0.693 . . . . 0.0 110.988 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -112.64 -61.33 1.74 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.751 -0.593 . . . . 0.0 111.794 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 1.3 m -120.23 157.64 28.68 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.264 0.554 . . . . 0.0 110.732 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -21.16 66.06 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.769 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 65.0 m-70 -56.85 -42.0 78.94 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.307 1.051 . . . . 0.0 108.327 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -28.62 69.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.424 177.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.699 HD11 HD23 ' A' ' 763' ' ' LEU . 0.1 OUTLIER -58.5 -37.47 75.65 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.571 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.99 -32.89 72.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.21 -47.52 73.59 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 122.206 -0.309 . . . . 0.0 111.053 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 763' ' ' LEU . 6.1 tp -61.13 -37.8 84.12 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.977 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 25.6 mt -58.59 -36.41 73.96 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.83 -0.544 . . . . 0.0 112.045 -177.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 32.5 mt -74.55 -48.54 26.28 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.495 -0.753 . . . . 0.0 111.632 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.69 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.9 pp -70.69 -37.36 68.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 O-C-N 122.178 -0.326 . . . . 0.0 111.619 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.69 ' N ' HD12 ' A' ' 777' ' ' ILE . 9.8 p -58.71 -44.34 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 21.0 p -64.06 -35.56 81.15 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-O 122.223 1.011 . . . . 0.0 109.504 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -60.79 -45.42 94.45 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.481 HD12 ' HB ' ' B' ' 746' ' ' ILE . 2.7 pt -64.53 -41.94 93.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.108 -177.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.67 -38.6 82.69 Favored 'Isoleucine or valine' 0 C--N 1.346 0.451 0 CA-C-N 119.066 0.848 . . . . 0.0 111.025 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.41 -45.6 83.32 Favored 'General case' 0 C--N 1.35 0.588 0 O-C-N 121.715 -0.616 . . . . 0.0 111.031 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.42 ' O ' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -70.49 -40.21 73.72 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.382 -179.292 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 787' ' ' ARG . 3.6 tp -66.35 -38.16 86.99 Favored 'General case' 0 C--O 1.214 -0.792 0 O-C-N 122.06 -0.4 . . . . 0.0 110.861 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -12.97 61.15 0.0 OUTLIER Glycine 0 N--CA 1.483 1.799 0 C-N-CA 126.039 1.78 . . . . 0.0 115.251 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 787' ' ' ARG . . . . . 0.624 ' N ' ' O ' ' A' ' 785' ' ' LEU . 7.8 ptm180 -137.58 148.56 45.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.435 0.636 . . . . 0.0 111.279 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.933 -1.032 . . . . 0.0 110.472 179.599 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 54.74 96.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.554 0.692 . . . . 0.0 110.483 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -173.39 164.99 4.71 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.14 -37.64 67.22 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.471 0.653 . . . . 0.0 109.9 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -65.28 -36.92 85.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.699 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 10.9 tttm -80.63 -49.22 11.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.218 0.532 . . . . 0.0 110.125 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -56.53 -44.28 80.66 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.462 0.649 . . . . 0.0 110.029 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.66 -28.95 69.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.362 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 23.0 t -62.07 -36.82 82.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 111.242 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.467 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.8 mm? -59.78 -23.73 63.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 122.055 -0.403 . . . . 0.0 111.719 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -59.55 -29.0 67.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.32 0.581 . . . . 0.0 110.288 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.05 -7.71 56.62 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.212 0.53 . . . . 0.0 110.846 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 672' ' ' TRP . . . . . 0.44 ' O ' ' N ' ' B' ' 674' ' ' ASP . 14.4 m95 -94.54 34.64 1.29 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.333 0.587 . . . . 0.0 109.802 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -39.81 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 122.087 0.946 . . . . 0.0 113.35 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 674' ' ' ASP . . . . . 0.44 ' N ' ' O ' ' B' ' 672' ' ' TRP . 1.6 t70 177.7 -66.07 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.672 0.748 . . . . 0.0 110.134 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.69 -36.93 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.099 0.56 . . . . 0.0 112.022 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.4 m -51.6 -33.74 34.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -64.38 -50.02 69.33 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 121.744 -0.597 . . . . 0.0 109.884 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.633 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.64 -43.05 90.64 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.748 0.785 . . . . 0.0 109.52 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.72 80.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 15.4 t90 -100.48 -45.9 5.4 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -63.55 -7.21 6.47 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.594 -0.691 . . . . 0.0 112.398 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.8 pp -60.44 -36.43 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 O-C-N 121.652 -0.655 . . . . 0.0 110.418 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' B' ' 682' ' ' ILE . 8.2 ttt-85 -53.7 -47.35 70.59 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.048 -0.408 . . . . 0.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.482 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.1 mp -69.01 -36.05 71.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -31.41 69.75 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.607 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.763 HD12 HG21 ' A' ' 686' ' ' ILE . 14.1 mm -60.68 -46.56 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.74 -41.45 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.29 -37.74 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 53.5 t -59.11 -40.12 80.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.89 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.23 -27.22 67.16 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.752 -0.592 . . . . 0.0 111.822 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.0 m -60.66 -41.43 95.0 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -177.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.646 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.3 -33.2 70.8 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 121.486 -0.759 . . . . 0.0 112.372 -176.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.776 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -66.27 -40.38 86.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 121.453 -0.779 . . . . 0.0 109.896 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.504 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.89 -33.94 85.4 Favored Glycine 0 CA--C 1.543 1.807 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.415 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.9 tt -69.81 -37.22 76.18 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.866 0.841 . . . . 0.0 110.323 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.46 ' HE ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -55.08 -27.5 45.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.447 1.099 . . . . 0.0 113.832 -178.574 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.504 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.8 tt -57.71 -34.86 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.26 -0.9 . . . . 0.0 109.704 -177.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.415 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.2 p -53.52 -28.93 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 O-C-N 121.603 -0.686 . . . . 0.0 110.002 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -55.39 -30.7 60.89 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.612 -0.68 . . . . 0.0 109.993 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.77 78.0 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.5 -41.13 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.78 -37.78 80.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.303 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 44.1 p -62.47 -41.69 98.95 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.57 -178.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.85 -40.58 89.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.677 0.751 . . . . 0.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.34 -43.61 87.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -62.72 -36.58 83.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.348 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -65.65 -49.39 68.82 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.703 1.239 . . . . 0.0 109.49 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD11 ' B' ' 748' ' ' LEU . 9.4 t -77.4 -45.37 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -176.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -63.91 -44.81 91.83 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -174.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 7.9 pt20 -104.59 -24.14 13.03 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.95 165.11 10.13 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 712' ' ' TYR . . . . . 0.487 ' O ' HD11 ' A' ' 704' ' ' LEU . 24.5 p90 -106.7 -57.28 2.08 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.195 -0.591 . . . . 0.0 112.166 -179.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 65.7 p -74.83 159.16 83.68 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.313 -0.851 . . . . 0.0 108.792 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -32.89 124.5 0.11 Allowed 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.238 1.959 . . . . 0.0 112.376 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.431 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.6 tt -79.09 -14.93 58.84 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 121.945 0.878 . . . . 0.0 112.538 -178.798 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.628 0 CA-C-O 121.39 0.614 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -71.34 -26.5 62.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.105 0.479 . . . . 0.0 111.259 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.5 -10.58 0.67 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -56.13 -30.73 62.54 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.365 -0.834 . . . . 0.0 110.311 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.49 -41.66 97.6 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -37.17 72.21 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.567 178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 745' ' ' SER . . . . . 0.495 ' O ' HD12 ' B' ' 748' ' ' LEU . 63.2 p -56.93 -36.0 69.73 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.481 ' HB ' HD12 ' A' ' 781' ' ' ILE . 1.2 mp -55.34 -18.3 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.405 HH11 HD11 ' A' ' 785' ' ' LEU . 14.9 ttm180 -59.48 -28.13 66.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.664 HD11 HG11 ' B' ' 708' ' ' VAL . 0.3 OUTLIER -55.54 -21.75 18.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.094 0.474 . . . . 0.0 109.856 177.838 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 749' ' ' VAL . . . . . 0.419 HG23 ' O ' ' B' ' 746' ' ' ILE . 54.1 t -55.84 -54.19 29.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -72.94 -24.48 60.81 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.436 174.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.08 33.57 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.77 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.68 -37.94 77.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.001 0.901 . . . . 0.0 108.948 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.78 -49.4 58.95 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.4 0.619 . . . . 0.0 109.762 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.41 80.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.248 0.547 . . . . 0.0 112.359 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.4 tt -60.24 -45.53 92.93 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.425 0.631 . . . . 0.0 110.882 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.73 -39.29 85.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 122.004 0.907 . . . . 0.0 108.653 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.44 68.62 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.082 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 85.7 m-20 -55.15 -49.07 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.456 -0.777 . . . . 0.0 110.963 -177.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -70.3 -40.86 73.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.109 0.481 . . . . 0.0 110.809 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.1 mt -69.15 -31.06 69.47 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.6 -49.75 56.91 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.828 -0.545 . . . . 0.0 112.271 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 4.0 m -69.18 -41.07 77.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.743 0.782 . . . . 0.0 110.921 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.545 ' HA ' HD22 ' B' ' 774' ' ' LEU . 2.2 tp -59.99 -53.31 59.31 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.471 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 764' ' ' SER . . . . . 0.425 ' HB2' HD12 ' B' ' 771' ' ' LEU . 23.1 t -97.35 -10.74 25.02 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.526 -0.734 . . . . 0.0 112.966 -178.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 mt 68.7 -73.47 0.09 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -138.76 -77.23 0.36 Allowed 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.864 -0.523 . . . . 0.0 110.08 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m -79.73 148.78 31.38 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.853 -0.529 . . . . 0.0 110.125 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -37.38 82.89 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.099 0.476 . . . . 0.0 110.122 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -54.46 -39.62 67.64 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.682 0.753 . . . . 0.0 109.494 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -59.49 -30.07 68.3 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.038 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 771' ' ' LEU . 3.8 tt -60.11 -38.41 82.91 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -40.52 85.19 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.23 -43.86 93.62 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.4 OUTLIER -59.51 -36.91 77.0 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 121.694 0.759 . . . . 0.0 110.539 178.567 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.85 -35.98 69.5 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.481 -0.762 . . . . 0.0 109.846 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 776' ' ' LEU . . . . . 0.45 ' O ' HG22 ' B' ' 779' ' ' THR . 70.8 mt -64.58 -37.65 88.28 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.85 -0.531 . . . . 0.0 110.797 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 9.9 pt -69.64 -35.49 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 O-C-N 121.63 -0.669 . . . . 0.0 109.393 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.407 ' HA ' HG12 ' B' ' 781' ' ' ILE . 72.6 t -54.04 -46.21 65.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 776' ' ' LEU . 4.8 t -64.02 -34.84 78.91 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.224 -0.922 . . . . 0.0 109.824 176.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -31.23 70.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 121.278 0.561 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.752 HD12 HG13 ' C' ' 746' ' ' ILE . 39.3 mm -54.35 -55.37 15.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.571 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.39 -38.75 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-O 121.655 0.741 . . . . 0.0 110.875 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.88 -41.87 95.27 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.745 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.37 -43.9 69.18 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.324 0.583 . . . . 0.0 111.285 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.694 HD23 ' OD1' ' C' ' 750' ' ' ASN . 5.4 tp -87.37 -9.37 55.0 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.63 -38.62 82.68 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.96 109.92 19.1 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 122.286 -0.538 . . . . 0.0 110.084 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.22 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.506 ' N ' HD23 ' C' ' 660' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.937 0 CA-C-O 120.419 0.152 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.409 HD22 ' CZ2' ' C' ' 666' ' ' TRP . 36.4 mt 56.04 99.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.48 0.657 . . . . 0.0 110.546 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.77 168.04 12.69 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.325 0.583 . . . . 0.0 110.236 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.525 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.3 tm? -43.58 -51.74 6.7 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.451 0.643 . . . . 0.0 112.232 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.481 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -71.9 -28.0 63.21 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -81.32 -32.27 33.15 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 122.05 -0.406 . . . . 0.0 111.496 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.409 ' CZ2' HD22 ' C' ' 661' ' ' LEU . 76.0 m95 -68.75 -46.35 69.05 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.236 0.541 . . . . 0.0 110.38 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.04 84.64 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.992 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -26.04 67.78 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.398 0.618 . . . . 0.0 110.63 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -34.37 74.21 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.16 0.505 . . . . 0.0 110.898 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -75.59 -14.57 60.39 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 122.13 -0.356 . . . . 0.0 111.749 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -67.64 -33.78 75.65 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.587 0.708 . . . . 0.0 110.334 179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m0 -55.99 -40.09 72.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.595 0.712 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.54 43.25 23.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.78 0.8 . . . . 0.0 111.398 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -159.69 -65.52 0.07 Allowed 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.62 -0.675 . . . . 0.0 112.016 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.74 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -67.6 -38.24 80.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 121.444 0.64 . . . . 0.0 111.432 -178.593 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.2 m -52.94 -33.79 52.46 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -62.11 -50.05 73.46 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.817 -0.552 . . . . 0.0 111.69 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.656 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -65.41 -44.23 88.07 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.431 0.634 . . . . 0.0 109.389 178.911 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.523 ' O ' HD23 ' C' ' 679' ' ' LEU . 1.1 tt -64.28 -35.78 81.95 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.069 -178.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -95.93 -20.51 18.7 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.72 -19.18 29.54 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.714 -0.616 . . . . 0.0 111.648 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.656 HG23 ' O ' ' C' ' 678' ' ' TRP . 7.6 pt -60.66 -36.8 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 O-C-N 121.836 -0.54 . . . . 0.0 110.321 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -55.02 -47.15 75.11 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.172 0.51 . . . . 0.0 110.036 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.401 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -67.8 -33.87 64.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.52 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -60.17 -29.78 68.9 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.859 179.643 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 8.0 mm -64.42 -47.4 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.305 0.574 . . . . 0.0 109.708 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.3 mt -64.74 -39.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.92 -37.71 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.458 HG23 ' O ' ' C' ' 685' ' ' PHE . 56.0 t -54.8 -40.91 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.61 -41.32 64.79 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.0 m -66.73 -38.5 86.81 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.864 0.84 . . . . 0.0 109.497 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.35 -43.7 92.77 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.171 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.711 HD11 ' HE ' ' A' ' 696' ' ' ARG . 0.1 OUTLIER -68.5 -42.23 83.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.956 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.476 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.58 -34.14 84.75 Favored Glycine 0 CA--C 1.535 1.338 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.82 -36.93 63.04 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.322 1.058 . . . . 0.0 110.173 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.776 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.9 mmt180 -55.62 -28.59 56.1 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.476 HG22 ' O ' ' C' ' 694' ' ' GLY . 6.8 tp -59.27 -36.59 64.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 O-C-N 121.076 -1.015 . . . . 0.0 112.083 -175.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -56.51 -30.74 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.294 -0.879 . . . . 0.0 110.439 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -58.59 -31.75 68.33 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.8 -45.45 92.29 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.484 ' O ' HG23 ' C' ' 705' ' ' VAL . 1.8 t -65.93 -39.31 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.643 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.75 -37.68 87.53 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.78 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -68.37 -37.81 80.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.219 0.533 . . . . 0.0 110.596 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.39 -40.83 93.95 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.873 0.844 . . . . 0.0 108.955 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.484 HG23 ' O ' ' C' ' 701' ' ' VAL . 71.6 t -67.63 -45.57 84.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.981 0.896 . . . . 0.0 108.947 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 706' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 2.3 m120 -63.15 -36.49 83.78 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.418 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -49.57 74.16 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.551 0.691 . . . . 0.0 111.119 -177.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 4.2 p -77.19 -41.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.599 0.714 . . . . 0.0 112.453 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.7 -40.22 63.78 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 710' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 0.9 OUTLIER -101.93 -21.34 14.55 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -175.842 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.08 170.93 12.78 Favored Glycine 0 N--CA 1.474 1.169 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -131.79 -53.93 1.0 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.03 -0.688 . . . . 0.0 111.86 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.484 ' HA ' HG21 ' B' ' 708' ' ' VAL . 51.5 p -90.35 152.26 45.39 Favored Pre-proline 0 C--O 1.232 0.144 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.748 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -35.89 98.59 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.397 2.064 . . . . 0.0 111.63 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.3 16.21 0.64 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -176.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.472 0.651 0 CA-C-O 121.794 0.807 . . . . 0.0 110.017 178.856 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 122.271 1.034 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -62.32 -26.36 68.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.958 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.03 -19.31 6.7 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.754 -0.591 . . . . 0.0 111.815 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.482 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.4 mtm105 -66.25 -32.84 74.5 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.246 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.55 -37.28 72.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -71.28 -36.57 71.73 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.858 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.1 p -56.82 -25.29 55.59 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.13 -0.356 . . . . 0.0 110.522 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.752 HG13 HD12 ' B' ' 781' ' ' ILE . 0.7 OUTLIER -52.79 -32.42 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.561 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -23.3 62.85 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.265 0.555 . . . . 0.0 111.648 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 tt -72.19 -33.94 68.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.006 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.73 -54.03 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.8 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.694 ' OD1' HD23 ' B' ' 785' ' ' LEU . 9.6 m120 -72.47 -13.89 61.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.759 0.79 . . . . 0.0 110.012 174.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.78 -20.83 41.66 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 121.973 -0.454 . . . . 0.0 112.71 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 2.4 m -58.85 -40.99 85.93 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 117.751 0.776 . . . . 0.0 109.839 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -68.59 -48.17 64.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.608 0.718 . . . . 0.0 109.557 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.1 -35.3 73.18 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.213 0.53 . . . . 0.0 111.291 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.53 ' C ' HD23 ' C' ' 755' ' ' LEU . 8.5 tt -59.65 -45.04 93.22 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.457 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.13 -40.69 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 109.818 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.26 -32.37 71.53 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.75 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -59.07 -39.26 81.55 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.533 -0.729 . . . . 0.0 109.124 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.41 -45.6 65.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.65 0.738 . . . . 0.0 111.509 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.41 -41.66 76.11 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.319 0.581 . . . . 0.0 112.564 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.41 -41.51 69.48 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.6 p -64.47 -45.48 87.19 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.427 HD22 HD11 ' C' ' 771' ' ' LEU . 0.2 OUTLIER -69.24 -55.0 11.84 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.683 -179.823 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.532 ' OG ' HD12 ' C' ' 771' ' ' LEU . 2.3 m -98.85 -43.46 6.74 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 765' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' C' ' 764' ' ' SER . 60.2 tp 85.71 -62.97 0.06 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.128 0.971 . . . . 0.0 110.36 -176.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.2 -74.13 0.46 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.486 -0.759 . . . . 0.0 111.887 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 68.2 m -106.58 159.47 16.16 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.734 -0.603 . . . . 0.0 111.125 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.35 -28.2 67.98 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 110.267 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -60.16 -40.6 90.48 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -30.74 69.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.286 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' OG ' ' C' ' 764' ' ' SER . 9.6 tt -60.3 -30.88 69.77 Favored 'General case' 0 C--N 1.344 0.366 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -39.27 73.93 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -65.51 -36.13 82.91 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.846 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.616 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -58.72 -37.91 77.18 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 121.489 0.662 . . . . 0.0 109.817 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.414 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.8 tp -57.45 -36.41 71.38 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.553 0.692 . . . . 0.0 109.431 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -36.14 64.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.405 0.621 . . . . 0.0 109.677 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 16.0 mt -62.07 -43.46 97.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.724 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.545 ' HA ' HD13 ' A' ' 746' ' ' ILE . 5.0 m -63.52 -45.92 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.917 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.491 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.4 p -64.11 -43.25 95.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.338 0.59 . . . . 0.0 112.109 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -32.15 72.78 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.021 -0.424 . . . . 0.0 112.075 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.66 ' CD1' HD12 ' A' ' 746' ' ' ILE . 79.5 mt -69.46 -43.78 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 O-C-N 121.801 -0.562 . . . . 0.0 111.607 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.491 HG22 ' O ' ' C' ' 779' ' ' THR . 26.8 m -56.06 -38.09 51.76 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 O-C-N 121.361 -0.837 . . . . 0.0 111.426 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -56.77 -41.88 78.41 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.435 -0.791 . . . . 0.0 111.331 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 59.7 tp -59.56 -42.62 92.81 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.046 0.45 . . . . 0.0 110.829 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 747' ' ' ARG . 7.9 tp -80.56 -25.76 38.4 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.207 0.527 . . . . 0.0 110.88 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -40.61 -40.03 1.97 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 111.816 -0.514 . . . . 0.0 111.816 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 115.21 13.18 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.71 0.767 . . . . 0.0 110.123 178.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.912 -1.042 . . . . 0.0 110.293 -179.7 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.455 HD13 ' CD2' ' C' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt 55.62 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.538 0.685 . . . . 0.0 110.341 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -175.03 169.54 3.34 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.549 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.3 tt -50.85 -40.05 55.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -68.58 -36.28 78.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.407 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -81.13 -42.64 20.6 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.29 0.567 . . . . 0.0 110.343 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -64.34 -46.31 84.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.07 0.462 . . . . 0.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.96 76.75 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.42 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.4 m -59.72 -33.1 71.19 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.276 0.56 . . . . 0.0 110.833 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.408 HD23 HG23 ' A' ' 676' ' ' THR . 2.7 tp -60.53 -29.82 69.36 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.019 0.438 . . . . 0.0 111.092 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -60.67 -20.71 61.63 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.796 -0.565 . . . . 0.0 111.881 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -81.96 -23.99 35.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.08 0.467 . . . . 0.0 111.287 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -58.12 -43.43 87.22 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.496 0.665 . . . . 0.0 110.609 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.7 t80 56.78 37.5 28.85 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.45 0.643 . . . . 0.0 111.796 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.42 -68.23 0.08 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.633 -0.667 . . . . 0.0 112.026 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.653 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.87 -37.14 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-O 121.533 0.683 . . . . 0.0 111.532 -178.953 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.408 HG23 HD23 ' A' ' 669' ' ' LEU . 9.1 m -51.88 -33.73 37.91 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -62.73 -49.68 74.08 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.338 0.589 . . . . 0.0 109.8 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.814 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.9 t90 -65.07 -43.96 90.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.633 0.73 . . . . 0.0 109.553 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -35.41 80.14 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.003 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -99.92 -12.47 19.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -100.61 -1.3 35.73 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.475 -0.766 . . . . 0.0 111.814 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.9 pt -64.25 -36.75 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 O-C-N 121.918 -0.488 . . . . 0.0 110.822 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -47.28 69.84 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.376 0.608 . . . . 0.0 110.114 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.449 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.8 mp -66.66 -26.18 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 177.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -74.1 -32.4 63.2 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.038 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.66 HG21 HD12 ' B' ' 686' ' ' ILE . 20.1 mm -60.67 -48.74 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 121.153 0.501 . . . . 0.0 110.476 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 72.5 mt -67.19 -36.63 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 121.379 0.609 . . . . 0.0 109.669 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mt -58.69 -37.82 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.72 -41.38 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 690' ' ' GLY . . . . . 0.402 ' O ' HG13 ' A' ' 693' ' ' ILE . . . -58.03 -33.92 70.81 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -67.35 -38.29 84.59 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.886 0.85 . . . . 0.0 110.514 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.474 HD23 HD11 ' C' ' 693' ' ' ILE . 0.3 OUTLIER -59.26 -42.01 90.16 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.463 -177.626 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.427 ' CD1' HD13 ' B' ' 692' ' ' LEU . 1.9 pp -64.95 -41.6 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.589 -0.695 . . . . 0.0 110.386 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.41 -18.36 50.2 Favored Glycine 0 CA--C 1.541 1.703 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.03 -38.24 87.9 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.789 0.804 . . . . 0.0 109.562 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.458 ' HD2' ' N ' ' A' ' 696' ' ' ARG . 7.7 mpt_? -55.58 -28.71 56.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.585 0.754 . . . . 0.0 111.963 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.4 -41.59 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 O-C-N 121.472 -0.767 . . . . 0.0 109.094 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.737 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -67.51 -30.25 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.251 -0.906 . . . . 0.0 110.078 177.272 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.39 -28.65 55.4 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.588 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.1 72.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.5 m -60.97 -37.4 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 121.684 -0.635 . . . . 0.0 109.74 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.02 -44.02 97.6 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.128 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 2.1 p -62.69 -32.53 73.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.898 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.562 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.2 OUTLIER -63.28 -43.82 96.83 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.385 1.088 . . . . 0.0 108.585 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.474 HG22 HD12 ' A' ' 748' ' ' LEU . 93.4 t -66.68 -41.92 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.431 178.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.29 -39.08 91.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.063 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -61.66 -48.68 79.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.104 0.954 . . . . 0.0 111.04 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.417 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -71.71 -44.39 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 122.29 1.043 . . . . 0.0 109.655 -179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -68.24 -20.57 64.82 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.871 -178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -97.11 -21.61 17.25 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.03 -1.044 . . . . 0.0 113.744 -177.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.06 69.98 0.72 Allowed Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.704 -0.622 . . . . 0.0 114.291 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 33.1 -134.73 0.03 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.416 ' CB ' HG21 ' C' ' 708' ' ' VAL . 97.3 p -62.81 159.33 45.75 Favored Pre-proline 0 C--N 1.353 0.752 0 O-C-N 121.166 -0.959 . . . . 0.0 112.01 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.72 105.74 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.189 0 C-N-CA 121.254 1.303 . . . . 0.0 111.504 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.7 pt? -101.34 -20.3 15.26 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.4 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 2.1 t . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 122.116 0.96 . . . . 0.0 109.41 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 122.157 0.98 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -57.93 -25.33 60.76 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.536 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -6.84 0.13 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -177.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 746' ' ' ILE . 9.9 ttm180 -59.71 -45.56 91.78 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.516 ' HA ' HD13 ' C' ' 781' ' ' ILE . 2.4 p30 -59.78 -32.13 70.32 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.662 0.744 . . . . 0.0 109.633 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 744' ' ' ARG . . . . . 0.754 ' HD3' HD13 ' C' ' 785' ' ' LEU . 20.1 mmt85 -71.07 -46.09 62.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 121.487 -0.758 . . . . 0.0 111.075 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 97.3 p -58.27 -31.62 67.61 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.493 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.577 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -65.93 -47.26 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 116.918 -1.515 . . . . 0.0 113.726 -179.2 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.751 ' HB3' HD23 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -86.78 -16.66 35.62 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 122.508 2.413 . . . . 0.0 108.597 178.407 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 748' ' ' LEU . 0.6 OUTLIER -56.03 -18.82 10.5 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 172.334 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.544 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 0.4 OUTLIER -55.83 -50.37 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 174.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -71.19 -23.1 61.97 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 122.584 1.183 . . . . 0.0 107.965 172.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.19 -18.33 20.28 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.401 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.5 p -56.49 -36.26 68.93 Favored 'General case' 0 C--N 1.344 0.361 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.15 -47.85 84.29 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 176.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.18 74.08 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.427 HD22 HG12 ' A' ' 701' ' ' VAL . 8.9 tt -59.7 -45.3 92.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.453 0.644 . . . . 0.0 110.492 -178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.9 mm -61.62 -33.18 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.31 -30.65 69.69 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.731 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.719 ' CG ' HD13 ' B' ' 715' ' ' LEU . 1.7 m-20 -55.44 -43.43 75.4 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.279 -0.888 . . . . 0.0 109.654 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -70.14 -44.76 68.21 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.315 0.578 . . . . 0.0 111.034 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.83 -35.66 81.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.279 0.561 . . . . 0.0 111.737 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.56 -35.22 65.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.943 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 13.1 t -69.64 -45.58 68.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.446 0.641 . . . . 0.0 111.094 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.726 ' HA ' HD13 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -68.76 -55.16 12.17 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -179.472 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 764' ' ' SER . . . . . 0.428 ' HB3' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -98.91 -49.68 4.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.537 0.684 . . . . 0.0 112.771 -179.256 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 12.0 tp 74.18 -62.2 0.47 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -137.96 134.86 35.42 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 58.67 174.51 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.07 0.462 . . . . 0.0 110.056 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -98.87 -27.04 14.09 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.042 -0.411 . . . . 0.0 111.266 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -52.94 -49.59 65.73 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.586 0.708 . . . . 0.0 110.493 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -56.55 -28.01 59.08 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.279 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.436 HD13 ' CE1' ' A' ' 768' ' ' TYR . 0.9 OUTLIER -57.62 -30.77 65.62 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.794 -0.566 . . . . 0.0 110.514 -176.371 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -62.4 -31.84 72.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.521 0.676 . . . . 0.0 109.291 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.33 -47.82 84.38 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.793 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.726 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.6 tt -58.89 -42.13 88.83 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.548 -179.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.16 -40.13 84.65 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.879 -0.513 . . . . 0.0 112.306 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 776' ' ' LEU . . . . . 0.434 ' O ' HG22 ' A' ' 779' ' ' THR . 60.6 mt -72.03 -37.73 69.67 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.39 -36.67 73.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.71 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.24 -46.38 77.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -63.82 -35.44 80.61 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.763 0.792 . . . . 0.0 110.293 178.065 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 23.7 tpt85 -67.09 -43.39 82.69 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.8 mt -63.59 -41.13 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.312 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 779' ' ' THR . 3.5 m -61.44 -38.67 80.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 121.499 -0.75 . . . . 0.0 110.272 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -61.25 -49.65 76.24 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 111.092 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.14 -44.12 69.53 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.202 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.76 -17.01 61.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.862 0.363 . . . . 0.0 111.826 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -77.45 52.01 3.39 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -137.11 150.69 48.16 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 122.201 -0.588 . . . . 0.0 110.901 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.348 179.437 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.679 ' HG ' HD22 ' B' ' 661' ' ' LEU . 4.3 tp . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.679 HD22 ' HG ' ' B' ' 660' ' ' LEU . 1.3 mm? 52.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.954 0.883 . . . . 0.0 111.056 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -171.43 -176.68 1.9 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.469 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.618 HD12 HD13 ' C' ' 660' ' ' LEU . 0.7 OUTLIER -53.52 -43.84 68.67 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.812 0.815 . . . . 0.0 110.105 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -71.69 -31.48 66.82 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.355 -0.838 . . . . 0.0 112.537 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -44.94 21.2 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.316 0.579 . . . . 0.0 110.918 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -70.62 -42.1 71.38 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.369 0.604 . . . . 0.0 110.654 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.04 -20.92 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.33 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.0 p -65.47 -35.2 80.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.221 0.534 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.42 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -59.67 -31.46 69.57 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.272 0.558 . . . . 0.0 110.931 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -59.88 -24.46 64.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.096 0.474 . . . . 0.0 111.201 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -84.57 -27.72 27.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.264 0.554 . . . . 0.0 111.189 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -60.73 -53.15 60.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.482 0.658 . . . . 0.0 110.67 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.51 41.69 7.19 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.775 0.797 . . . . 0.0 111.538 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -156.68 -63.34 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.631 -0.668 . . . . 0.0 111.371 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.634 HG13 HD23 ' B' ' 679' ' ' LEU . 7.1 tp -68.42 -37.33 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.803 -0.561 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.7 m -52.36 -33.64 43.95 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.141 -0.349 . . . . 0.0 111.501 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 677' ' ' ASN . . . . . 0.404 ' OD1' ' CZ ' ' B' ' 681' ' ' TYR . 43.0 m-20 -62.12 -49.21 76.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.292 0.568 . . . . 0.0 110.166 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.645 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.6 t90 -65.62 -44.24 87.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 121.749 0.785 . . . . 0.0 109.814 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.634 HD23 HG13 ' B' ' 675' ' ' ILE . 3.7 mm? -64.78 -35.29 80.62 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -94.39 -34.81 12.62 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 681' ' ' TYR . . . . . 0.404 ' CZ ' ' OD1' ' B' ' 677' ' ' ASN . 20.7 m-30 -71.2 -20.95 62.21 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.928 -0.483 . . . . 0.0 111.77 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.775 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.6 -36.43 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 121.9 -0.5 . . . . 0.0 110.224 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 683' ' ' ARG . . . . . 0.775 ' N ' HD12 ' B' ' 682' ' ' ILE . 9.3 ttt-85 -54.52 -47.47 73.07 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.015 0.436 . . . . 0.0 110.875 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.438 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -69.04 -37.16 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.463 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.0 -30.43 69.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.427 -179.091 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.66 HD12 HG21 ' A' ' 686' ' ' ILE . 13.8 mm -60.62 -48.78 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 121.877 -0.515 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 81.4 mt -61.71 -42.24 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.09 -37.74 69.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 685' ' ' PHE . 68.5 t -56.22 -39.87 62.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.06 -27.16 68.41 Favored Glycine 0 CA--C 1.543 1.815 0 O-C-N 121.759 -0.588 . . . . 0.0 112.083 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.8 m -64.69 -45.89 84.69 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.621 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.41 -33.08 70.8 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -175.887 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.683 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -60.06 -41.5 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.23 -0.919 . . . . 0.0 109.278 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.545 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.2 -29.7 71.9 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 177.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.576 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -60.35 -37.62 81.24 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.943 0.877 . . . . 0.0 110.056 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 23.8 mmt180 -55.35 -27.42 47.18 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.206 1.188 . . . . 0.0 114.206 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.545 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.0 tp -58.0 -36.22 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 120.623 -1.298 . . . . 0.0 109.796 -176.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.576 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.0 p -66.67 -30.98 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.586 -0.696 . . . . 0.0 109.577 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.3 m-85 -56.6 -30.59 63.41 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.52 76.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.402 ' O ' HG23 ' B' ' 705' ' ' VAL . 0.5 OUTLIER -65.85 -40.81 88.63 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.3 tp -57.39 -37.97 73.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.123 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 48.0 m -64.12 -41.44 97.23 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.884 0.849 . . . . 0.0 109.885 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -43.58 98.41 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 122.162 0.982 . . . . 0.0 109.124 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 701' ' ' VAL . 97.9 t -67.51 -40.83 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.165 -0.925 . . . . 0.0 108.878 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.452 ' ND2' ' OE1' ' B' ' 710' ' ' GLN . 2.2 m120 -62.69 -36.76 83.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.072 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.562 ' NH2' HD22 ' A' ' 704' ' ' LEU . 63.0 mtt-85 -61.94 -47.21 85.9 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 122.263 1.03 . . . . 0.0 109.931 -179.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.524 HG21 ' HA ' ' C' ' 713' ' ' SER . 3.7 t -76.95 -45.55 30.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.727 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -37.96 65.11 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.368 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.629 ' O ' HD12 ' B' ' 715' ' ' LEU . 0.0 OUTLIER -101.95 -22.09 14.38 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.124 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 110.08 146.5 11.16 Favored Glycine 0 CA--C 1.53 1.006 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -89.5 -60.55 1.91 Allowed 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.09 -0.653 . . . . 0.0 112.339 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.71 159.31 85.65 Favored Pre-proline 0 CA--C 1.538 0.513 0 O-C-N 121.516 -0.74 . . . . 0.0 109.33 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.43 ' HB3' HD23 ' A' ' 748' ' ' LEU . 43.3 Cg_exo -27.47 139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.931 2.421 . . . . 0.0 114.26 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.719 HD13 ' CG ' ' A' ' 758' ' ' ASP . 8.7 tt -106.22 -20.46 13.39 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 122.396 1.093 . . . . 0.0 111.814 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 122.095 0.95 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -57.99 -26.64 62.61 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.262 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -13.58 1.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.811 -0.556 . . . . 0.0 112.264 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.53 ' HE ' HD12 ' A' ' 774' ' ' LEU . 51.4 mtm-85 -66.01 -46.29 78.47 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.498 -0.751 . . . . 0.0 110.915 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -30.97 67.57 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.728 -0.607 . . . . 0.0 109.588 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -48.87 51.82 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.416 0.627 . . . . 0.0 109.716 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.3 p -58.35 -44.43 88.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 122.111 -0.368 . . . . 0.0 110.643 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.66 -20.16 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.49 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -59.43 -33.69 71.57 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.6 ' O ' HD23 ' B' ' 748' ' ' LEU . 0.9 OUTLIER -58.67 -16.28 15.57 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 22.3 t -55.96 -53.8 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -72.04 -24.73 61.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.067 175.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.2 -20.6 36.32 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.236 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 2.3 m -58.99 -40.6 85.34 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 121.99 -0.712 . . . . 0.0 109.238 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.9 tp -65.7 -51.15 61.62 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.401 0.62 . . . . 0.0 109.378 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.65 -35.17 75.55 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.187 0.518 . . . . 0.0 111.345 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.43 -45.23 92.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.173 0.511 . . . . 0.0 110.891 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.02 -37.64 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -68.82 -30.34 68.87 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.301 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' C' ' 715' ' ' LEU . 68.1 m-20 -55.25 -49.32 72.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.346 -0.846 . . . . 0.0 110.27 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.42 -41.09 73.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.723 0.773 . . . . 0.0 110.567 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -36.23 83.45 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.198 -178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.1 -50.28 9.24 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.256 0.55 . . . . 0.0 111.775 -178.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 61.6 m -61.81 -46.09 91.02 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.825 0.821 . . . . 0.0 111.116 -178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.502 ' O ' HD13 ' B' ' 774' ' ' LEU . 8.4 tt -69.02 -53.67 19.26 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' B' ' 771' ' ' LEU . 1.2 m -97.73 -39.43 9.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -176.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 765' ' ' LEU . . . . . 0.544 HD13 HD11 ' B' ' 774' ' ' LEU . 0.5 OUTLIER 81.8 -167.59 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -177.284 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -38.37 -66.88 0.23 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 9.5 t -114.82 168.96 9.44 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.606 0.717 . . . . 0.0 111.713 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.92 -17.64 62.08 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.114 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -38.94 91.94 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -67.86 -29.91 69.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.744 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' B' ' 764' ' ' SER . 6.6 tt -59.79 -34.62 73.27 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 122.023 -0.423 . . . . 0.0 109.961 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 40.6 mmm-85 -61.19 -37.95 84.81 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.94 -43.64 74.66 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.283 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.544 HD11 HD13 ' B' ' 765' ' ' LEU . 9.3 mt -66.99 -38.21 85.61 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.752 0.787 . . . . 0.0 110.584 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.695 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -66.91 -38.62 86.57 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.022 -179.762 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.42 -41.65 60.53 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.554 -0.716 . . . . 0.0 111.567 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 777' ' ' ILE . . . . . 0.575 HD12 ' N ' ' B' ' 778' ' ' VAL . 2.7 pp -68.19 -37.09 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 120.524 -0.471 . . . . 0.0 110.501 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.575 ' N ' HD12 ' B' ' 777' ' ' ILE . 0.7 OUTLIER -55.56 -45.5 78.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.655 -0.653 . . . . 0.0 109.328 -179.296 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.818 ' O ' HG22 ' B' ' 782' ' ' VAL . 29.7 p -64.46 -42.13 96.11 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 111.395 178.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -31.82 72.37 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.433 ' HB ' HG21 ' C' ' 746' ' ' ILE . 79.3 mt -61.07 -36.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.818 HG22 ' O ' ' B' ' 779' ' ' THR . 11.4 m -54.16 -37.4 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.413 -0.805 . . . . 0.0 110.043 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -54.31 -46.32 72.77 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.528 0.68 . . . . 0.0 110.505 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.23 -44.32 84.12 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.051 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' C' ' 747' ' ' ARG . 5.1 tp -71.77 -23.91 61.66 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.183 0.516 . . . . 0.0 111.129 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.86 -41.45 20.58 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.49 128.94 33.99 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.603 0.716 . . . . 0.0 110.462 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.071 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.618 HD13 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 121.592 0.71 . . . . 0.0 109.218 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 49.3 mt 59.96 113.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.46 0.648 . . . . 0.0 110.9 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -172.88 170.44 4.55 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.881 0.848 . . . . 0.0 110.524 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.67 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -55.49 -53.97 49.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.466 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.67 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.4 t70 -72.7 -15.74 61.68 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.775 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.06 -42.57 31.85 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.141 0.496 . . . . 0.0 110.896 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -69.2 -46.14 68.17 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.461 0.648 . . . . 0.0 110.949 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.66 -27.84 66.73 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.652 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 32.8 t -63.23 -26.49 68.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.138 0.494 . . . . 0.0 111.694 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -39.75 95.09 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.093 0.473 . . . . 0.0 111.569 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -60.44 -21.17 62.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.017 0.437 . . . . 0.0 111.642 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -79.13 -29.4 43.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.358 0.599 . . . . 0.0 111.093 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -58.45 -52.18 66.71 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.592 0.71 . . . . 0.0 110.51 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.6 t80 58.54 59.9 2.77 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.173 0.987 . . . . 0.0 111.068 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -176.0 -76.26 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.138 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.424 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.4 OUTLIER -67.42 -36.76 77.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-O 121.593 0.711 . . . . 0.0 111.947 -178.658 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 8.0 m -51.41 -32.43 26.33 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -55.79 -43.51 76.89 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.708 -0.62 . . . . 0.0 110.986 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.623 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.68 -44.52 96.79 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.512 0.673 . . . . 0.0 109.863 179.246 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.86 81.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.015 0.436 . . . . 0.0 111.792 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -88.33 -17.87 29.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -101.45 -20.34 15.17 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.687 -0.633 . . . . 0.0 112.121 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.762 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -60.5 -36.68 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 O-C-N 121.784 -0.573 . . . . 0.0 110.904 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.762 ' N ' HD12 ' C' ' 682' ' ' ILE . 5.6 ttt-85 -58.22 -46.74 85.34 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.717 0.77 . . . . 0.0 109.378 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 59.1 mt -71.15 -35.18 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-O 121.391 0.615 . . . . 0.0 109.673 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.52 -31.11 69.09 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.9 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.412 HD12 ' CG2' ' B' ' 686' ' ' ILE . 14.0 mm -61.05 -44.2 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 75.5 mt -62.25 -37.5 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 177.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.17 -40.95 85.01 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 86.7 t -54.97 -43.83 70.88 Favored 'Isoleucine or valine' 0 C--N 1.347 0.471 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.44 -39.2 43.87 Favored Glycine 0 CA--C 1.534 1.23 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.39 -38.88 85.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.307 1.051 . . . . 0.0 109.519 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -61.01 -46.26 91.47 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.474 HD11 HD23 ' A' ' 692' ' ' LEU . 1.3 pp -65.75 -41.57 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.388 0.613 . . . . 0.0 110.157 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.575 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.8 -35.23 89.65 Favored Glycine 0 CA--C 1.535 1.319 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.585 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.0 tt -56.11 -37.62 69.66 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.086 0.946 . . . . 0.0 110.095 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.683 ' HE ' HD11 ' B' ' 693' ' ' ILE . 31.1 mmt180 -55.83 -28.17 55.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.575 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.5 tt -58.28 -35.59 54.21 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 121.158 -0.964 . . . . 0.0 111.082 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.585 HG12 ' O ' ' C' ' 695' ' ' LEU . 10.8 p -54.28 -29.68 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -56.22 -31.14 63.24 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.728 -0.607 . . . . 0.0 110.735 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.07 -37.66 77.62 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.23 -40.91 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.54 -38.34 84.13 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.536 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 43.8 p -64.17 -36.49 84.22 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.286 0.565 . . . . 0.0 110.594 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -43.29 96.8 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 122.174 0.988 . . . . 0.0 108.533 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.94 -45.05 99.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.883 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -62.71 -36.77 84.05 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.407 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.453 ' HG2' ' HB3' ' C' ' 712' ' ' TYR . 0.0 OUTLIER -62.13 -50.22 72.76 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.409 -0.807 . . . . 0.0 110.333 -177.758 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.418 HG12 ' CD1' ' C' ' 748' ' ' LEU . 0.9 OUTLIER -77.57 -44.19 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -177.334 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.06 -44.58 65.49 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -104.1 -22.25 13.45 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.34 173.82 16.09 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 712' ' ' TYR . . . . . 0.453 ' HB3' ' HG2' ' C' ' 707' ' ' ARG . 14.3 p90 -134.49 -58.37 0.83 Allowed 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.6 -0.941 . . . . 0.0 112.628 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.524 ' HA ' HG21 ' B' ' 708' ' ' VAL . 53.1 p -64.19 154.46 82.64 Favored Pre-proline 0 C--N 1.343 0.307 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.574 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -36.41 96.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.806 0 C-N-CA 121.933 1.755 . . . . 0.0 111.554 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.477 HD23 ' OD2' ' B' ' 758' ' ' ASP . 5.8 tp -82.83 16.85 2.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -175.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.009 0.909 . . . . 0.0 109.728 179.134 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 121.824 0.821 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -40.79 95.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.094 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.72 -38.1 77.62 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.063 0.459 . . . . 0.0 111.821 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.501 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.3 ttm-85 -58.3 -36.51 73.44 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.099 -0.376 . . . . 0.0 111.191 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.52 -42.98 88.95 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -71.28 -44.17 65.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.71 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -27.97 58.98 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.36 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -58.15 -14.64 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 747' ' ' ARG . . . . . 0.477 ' HA ' HD22 ' B' ' 785' ' ' LEU . 0.1 OUTLIER -59.45 -25.5 64.42 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 121.315 -0.865 . . . . 0.0 108.783 178.344 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' C' ' 708' ' ' VAL . 0.8 OUTLIER -55.38 -24.71 31.36 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.885 177.849 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.76 -54.03 30.78 Favored 'Isoleucine or valine' 0 C--N 1.349 0.577 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.426 ' CG ' HD23 ' B' ' 785' ' ' LEU . 8.7 m120 -72.54 -22.81 60.96 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.746 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.73 36.05 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.136 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.8 t -58.78 -40.87 85.25 Favored 'General case' 0 C--O 1.234 0.237 0 O-C-N 122.031 -0.688 . . . . 0.0 109.458 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.63 -48.96 67.81 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.371 0.605 . . . . 0.0 110.254 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 754' ' ' ALA . . . . . 0.4 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.89 -35.22 79.94 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 111.86 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.459 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.4 tt -59.26 -45.16 91.95 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 110.74 -178.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 51.1 mt -68.55 -36.36 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 121.502 0.668 . . . . 0.0 109.714 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.66 -30.36 69.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.34 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -55.44 -45.37 76.84 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.737 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -45.18 66.16 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 179.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.86 -45.96 69.69 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -67.3 -47.82 69.45 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.3 m -64.07 -45.15 90.02 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.901 0.858 . . . . 0.0 110.58 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.39 -53.31 24.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.0 OUTLIER -98.23 -36.92 9.88 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.044 -1.035 . . . . 0.0 113.309 -177.82 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 765' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' C' ' 766' ' ' PHE . 60.5 mt 65.0 177.68 0.19 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -177.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 766' ' ' PHE . . . . . 0.416 ' C ' ' O ' ' C' ' 765' ' ' LEU . 27.6 t80 -7.01 -66.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -178.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 54.7 p -130.38 172.38 11.93 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.171 0.51 . . . . 0.0 110.676 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.82 -15.73 63.77 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.792 0.33 . . . . 0.0 111.32 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -63.76 -42.16 97.86 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -64.07 -30.33 71.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.801 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' C' ' 764' ' ' SER . 0.8 OUTLIER -60.16 -32.3 70.92 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.953 -0.467 . . . . 0.0 110.015 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 17.3 ttt-85 -62.6 -38.82 91.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -67.7 -43.95 78.88 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.446 HD22 HD12 ' C' ' 777' ' ' ILE . 3.3 mm? -61.39 -37.47 83.54 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.435 ' O ' HG22 ' C' ' 778' ' ' VAL . 1.0 OUTLIER -57.71 -36.26 71.76 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.243 1.021 . . . . 0.0 108.707 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 776' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 776' ' ' LEU . 8.6 tt -74.31 -41.33 61.33 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.704 0.764 . . . . 0.0 109.543 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.728 HG22 HD11 ' C' ' 781' ' ' ILE . 94.3 mt -60.91 -45.63 97.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.87 -179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.493 HG12 HG12 ' A' ' 746' ' ' ILE . 32.7 m -57.74 -39.19 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.57 -0.706 . . . . 0.0 111.102 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.589 ' O ' HG22 ' C' ' 782' ' ' VAL . 7.2 m -63.22 -48.02 80.05 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.629 -0.67 . . . . 0.0 112.065 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -31.81 72.0 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.751 -0.593 . . . . 0.0 111.451 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.728 HD11 HG22 ' C' ' 777' ' ' ILE . 63.4 mt -60.1 -40.22 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.368 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.589 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -53.02 -38.03 28.14 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 CA-C-N 120.185 1.357 . . . . 0.0 109.555 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -42.34 94.16 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 121.786 -0.571 . . . . 0.0 109.588 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.84 -45.01 65.29 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.754 HD13 ' HD3' ' A' ' 744' ' ' ARG . 17.9 tp -78.6 -18.86 53.92 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.985 -1.072 . . . . 0.0 110.441 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.26 -26.09 12.89 Favored Glycine 0 CA--C 1.54 1.643 0 N-CA-C 109.9 -1.28 . . . . 0.0 109.9 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 141.67 47.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 118.167 -0.92 . . . . 0.0 110.301 179.627 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.514 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.5 mp 61.57 116.34 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.469 0.652 . . . . 0.0 110.279 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -177.33 173.39 1.74 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.491 0.662 . . . . 0.0 110.086 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -51.68 -43.25 62.66 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.675 0.75 . . . . 0.0 111.118 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.31 -34.89 71.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.752 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.0 mmtt -72.03 -43.08 65.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.178 0.514 . . . . 0.0 111.301 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -67.07 -46.41 74.36 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.133 0.492 . . . . 0.0 110.596 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.44 90.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.376 0.608 . . . . 0.0 111.446 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.26 -33.25 69.18 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.248 0.547 . . . . 0.0 111.085 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.917 HD23 HG23 ' A' ' 676' ' ' THR . 10.9 tp -62.5 -25.57 68.08 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.168 -0.332 . . . . 0.0 111.799 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -61.3 -24.68 66.59 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.736 -0.603 . . . . 0.0 111.127 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -74.87 -31.38 61.6 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.334 0.588 . . . . 0.0 110.858 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 17.7 m95 -55.43 -50.46 69.74 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.683 0.754 . . . . 0.0 109.942 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 17.5 t80 58.7 12.34 2.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -124.98 -60.36 1.36 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.595 -0.691 . . . . 0.0 110.55 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -68.49 -36.66 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.485 0.66 . . . . 0.0 110.751 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.917 HG23 HD23 ' A' ' 669' ' ' LEU . 0.2 OUTLIER -51.72 -33.87 36.49 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -175.663 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -63.7 -49.75 71.88 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.2 0.909 . . . . 0.0 110.253 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.749 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.6 t90 -65.59 -43.85 88.43 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.724 0.773 . . . . 0.0 109.525 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -35.71 81.87 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.8 t90 -101.64 -17.84 16.14 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -92.41 -8.21 45.45 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.432 -0.792 . . . . 0.0 112.053 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.749 HG23 ' O ' ' A' ' 678' ' ' TRP . 5.3 pt -61.06 -36.96 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.708 -0.62 . . . . 0.0 111.002 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.88 -47.44 71.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.946 0.403 . . . . 0.0 110.578 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.0 mp -70.71 -33.45 52.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 177.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.503 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.5 OUTLIER -59.81 -32.48 70.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.892 -179.767 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.968 HD12 HG21 ' C' ' 686' ' ' ILE . 11.0 mm -62.68 -43.25 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-O 121.526 0.679 . . . . 0.0 109.19 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 54.5 mt -66.65 -41.23 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.99 -38.27 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 685' ' ' PHE . 78.7 t -56.99 -41.03 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 177.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 690' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -58.31 -39.26 92.38 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 177.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -61.22 -38.9 88.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.318 1.056 . . . . 0.0 109.663 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.56 -46.1 91.46 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.791 -178.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.635 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -58.04 -42.2 82.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.128 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.72 -36.54 92.87 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.466 ' O ' HD23 ' A' ' 695' ' ' LEU . 2.8 tt -59.57 -41.88 91.2 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.835 0.826 . . . . 0.0 110.146 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.476 ' HG3' HD13 ' C' ' 693' ' ' ILE . 30.8 mmt180 -56.12 -28.55 58.3 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 49.1 mm -58.96 -35.68 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.52 -0.738 . . . . 0.0 110.831 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 4.1 p -53.98 -29.56 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 O-C-N 121.436 -0.79 . . . . 0.0 110.126 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -55.65 -30.85 61.71 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.843 -0.536 . . . . 0.0 110.41 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.72 77.44 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.21 -41.17 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.25 -36.98 76.45 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.746 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 703' ' ' SER . . . . . 0.429 ' HA ' ' HB2' ' A' ' 706' ' ' ASN . 0.9 OUTLIER -61.98 -41.66 98.28 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.358 0.599 . . . . 0.0 110.507 -178.308 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 704' ' ' LEU . 0.8 OUTLIER -60.94 -40.91 95.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 122.026 0.917 . . . . 0.0 108.982 178.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -68.33 -41.82 83.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.914 0.864 . . . . 0.0 108.908 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 706' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 703' ' ' SER . 2.3 m120 -62.72 -45.01 94.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -61.08 -39.33 89.5 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.815 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.9 -44.48 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 122.246 1.022 . . . . 0.0 108.824 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -69.56 -16.81 63.49 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.595 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -93.84 7.75 43.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.494 -0.754 . . . . 0.0 112.644 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 71.83 42.7 52.57 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 110.121 -1.191 . . . . 0.0 110.121 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.55 -167.47 0.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.117 0.961 . . . . 0.0 109.935 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.548 ' OG ' HG23 ' C' ' 708' ' ' VAL . 16.8 p -62.72 160.35 36.66 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.671 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.416 ' CG ' HD12 ' C' ' 748' ' ' LEU . 10.7 Cg_exo -24.34 100.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 123.86 3.04 . . . . 0.0 115.608 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.667 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.3 pt? -109.55 -20.26 12.93 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.336 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 123.068 1.414 . . . . 0.0 109.863 -178.527 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 124.244 1.973 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.38 -25.24 59.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 113.64 -1.618 . . . . 0.0 112.486 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -54.21 -30.27 49.33 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.567 ' O ' HD12 ' A' ' 746' ' ' ILE . 2.4 ttp180 -61.12 -42.68 98.98 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.406 -0.809 . . . . 0.0 110.775 178.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.93 -44.34 91.33 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.799 0.809 . . . . 0.0 110.02 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -36.89 72.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 745' ' ' SER . . . . . 0.449 ' HA ' HD23 ' A' ' 748' ' ' LEU . 42.9 p -64.58 -28.17 69.45 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.786 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.567 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.9 OUTLIER -74.0 -47.1 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.695 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.591 ' HB3' HD23 ' C' ' 785' ' ' LEU 0.28 9.4 ttt180 -71.9 0.73 8.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.763 -178.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.538 HD21 ' CG ' ' B' ' 714' ' ' PRO . 1.1 mm? -55.71 -16.61 4.48 Favored 'General case' 0 C--N 1.375 1.691 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 168.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.313 1.4 t -53.52 -54.77 16.64 Favored 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.406 ' HB2' ' HG3' ' A' ' 747' ' ' ARG . 5.4 m120 -73.52 -28.38 61.86 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.261 174.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.15 -20.49 35.57 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.528 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 81.2 p -58.23 -37.58 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.741 0.77 . . . . 0.0 109.187 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 38.1 tp -66.75 -51.14 59.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.185 0.517 . . . . 0.0 109.748 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.62 -35.07 79.3 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.226 0.536 . . . . 0.0 112.106 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.492 HD21 ' NE2' ' B' ' 710' ' ' GLN . 4.7 tt -59.18 -45.36 91.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.977 0.417 . . . . 0.0 111.411 -177.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.4 mt -65.41 -31.88 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 121.335 0.588 . . . . 0.0 109.862 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.54 -30.74 68.63 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 122.049 -0.407 . . . . 0.0 111.799 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -55.67 -46.59 77.53 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.586 -0.696 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -43.32 70.09 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.461 0.648 . . . . 0.0 110.899 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 763' ' ' LEU . 7.2 mt -60.99 -33.36 73.11 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.253 0.549 . . . . 0.0 111.463 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 761' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 765' ' ' LEU . 71.6 mtt180 -82.33 -22.15 35.72 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.4 m -75.3 -46.68 31.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 120.959 -1.088 . . . . 0.0 112.299 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.452 HD11 ' HA ' ' A' ' 760' ' ' LEU . 0.1 OUTLIER -69.65 -53.72 17.34 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -41.49 8.2 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.411 ' HA ' ' O ' ' A' ' 761' ' ' ARG . 1.2 tt 92.1 -64.58 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.212 1.005 . . . . 0.0 111.787 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -151.2 25.08 0.72 Allowed 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.616 -0.677 . . . . 0.0 112.732 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 18.9 p -176.34 138.33 0.31 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.596 -0.69 . . . . 0.0 110.818 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.86 -5.34 25.12 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.861 0.362 . . . . 0.0 111.46 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -82.83 -38.6 22.82 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -61.31 -30.28 70.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.258 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.98 -33.42 71.92 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.043 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -57.03 -38.06 72.62 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.28 -38.13 78.2 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.639 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.538 ' C ' HD13 ' A' ' 774' ' ' LEU . 2.8 tm? -58.19 -39.57 79.28 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 121.302 0.572 . . . . 0.0 109.805 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.65 -36.2 80.12 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.547 0.689 . . . . 0.0 110.783 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -45.36 52.5 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.962 0.41 . . . . 0.0 111.161 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.796 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -69.94 -37.59 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 122.046 -0.409 . . . . 0.0 110.076 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.796 ' N ' HD13 ' A' ' 777' ' ' ILE . 13.4 p -61.64 -42.87 95.87 Favored 'Isoleucine or valine' 0 C--N 1.348 0.54 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.848 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.1 m -64.21 -35.84 82.13 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.306 0.574 . . . . 0.0 110.33 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 780' ' ' ARG . . . . . 0.692 ' NH2' HD21 ' A' ' 784' ' ' LEU . 0.7 OUTLIER -63.67 -37.65 88.14 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.611 HG21 HG23 ' B' ' 746' ' ' ILE . 72.8 mt -54.01 -39.71 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 121.796 -0.565 . . . . 0.0 111.342 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.848 HG22 ' O ' ' A' ' 779' ' ' THR . 6.8 m -54.76 -35.75 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 120.933 0.397 . . . . 0.0 111.041 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -53.81 -51.12 64.51 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -176.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.692 HD21 ' NH2' ' A' ' 780' ' ' ARG . 0.0 OUTLIER -70.59 -32.98 70.55 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.032 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 mp -84.59 -25.46 28.62 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.751 -0.593 . . . . 0.0 111.94 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.62 -45.91 89.59 Favored Glycine 0 CA--C 1.529 0.96 0 N-CA-C 109.989 -1.244 . . . . 0.0 109.989 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -88.28 145.29 25.94 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.539 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.146 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.51 HD12 ' N ' ' B' ' 660' ' ' LEU . 6.5 mp . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.707 0.765 . . . . 0.0 109.115 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.468 HD12 ' N ' ' B' ' 661' ' ' LEU . 7.9 mp 45.5 90.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.556 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.76 52.42 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 122.112 0.958 . . . . 0.0 111.409 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.623 ' CD1' HD22 ' C' ' 660' ' ' LEU . 13.6 tp 77.77 -46.45 0.46 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.275 1.03 . . . . 0.0 110.151 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -34.29 72.12 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.438 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.64 -41.38 27.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.825 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -75.19 -42.4 55.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.04 0.448 . . . . 0.0 111.742 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.96 -29.69 64.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.393 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.5 m -62.43 -33.79 75.49 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.084 0.468 . . . . 0.0 111.195 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -27.19 68.93 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.027 0.441 . . . . 0.0 111.588 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.0 m95 -59.79 -32.62 70.79 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.156 0.503 . . . . 0.0 111.002 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -69.6 -27.86 65.46 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.105 0.479 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -67.86 -61.5 1.84 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.513 0.673 . . . . 0.0 110.336 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 11.9 t80 63.53 24.49 14.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -132.64 -82.15 0.49 Allowed 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.446 -0.784 . . . . 0.0 111.23 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.711 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.2 OUTLIER -62.42 -36.04 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.417 0.627 . . . . 0.0 110.611 179.498 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.0 m -50.73 -33.13 21.75 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.02 -0.425 . . . . 0.0 110.749 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 19.7 m-20 -56.48 -49.71 73.86 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' B' ' 682' ' ' ILE . 4.1 t90 -66.06 -43.57 87.04 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.81 0.814 . . . . 0.0 109.357 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 675' ' ' ILE . 0.1 OUTLIER -58.15 -35.15 71.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.064 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -105.55 -33.74 8.0 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -176.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -70.09 -8.71 51.66 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.33 -35.8 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.506 -0.746 . . . . 0.0 111.456 179.542 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -47.3 68.74 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 122.118 -0.364 . . . . 0.0 110.907 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.463 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -68.31 -36.21 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.493 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.6 OUTLIER -59.82 -30.8 69.18 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.246 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.896 HD12 HG21 ' A' ' 686' ' ' ILE . 13.0 mm -60.91 -47.11 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.142 0.496 . . . . 0.0 109.762 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 70.3 mt -61.21 -39.44 82.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' B' ' 685' ' ' PHE . 96.6 mt -58.72 -37.57 66.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 685' ' ' PHE . 96.9 t -56.17 -41.93 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.52 -28.21 59.35 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.2 -37.44 87.49 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.996 0.518 . . . . 0.0 110.975 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.26 -45.83 87.12 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.224 0.535 . . . . 0.0 109.997 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.74 HD11 ' NE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -68.34 -40.25 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 O-C-N 122.174 -0.329 . . . . 0.0 110.945 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.694 ' O ' HD12 ' B' ' 697' ' ' ILE . . . -61.89 -38.44 96.0 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 109.906 -1.278 . . . . 0.0 109.906 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.595 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -64.62 -36.49 84.41 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.411 1.1 . . . . 0.0 110.705 178.62 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.628 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -54.78 -28.57 49.85 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -176.808 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.729 HD13 ' H ' ' B' ' 698' ' ' VAL . 0.1 OUTLIER -58.55 -35.57 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 120.839 -1.163 . . . . 0.0 110.092 -177.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.729 ' H ' HD13 ' B' ' 697' ' ' ILE . 9.9 p -54.34 -30.3 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.263 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -56.7 -31.47 64.51 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 121.96 -0.462 . . . . 0.0 109.859 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.33 -38.38 80.19 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.02 -39.2 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tp -62.0 -36.38 81.34 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.326 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -62.1 -37.18 84.1 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 122.04 -0.413 . . . . 0.0 110.563 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.46 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -63.6 -42.59 98.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 122.215 1.007 . . . . 0.0 108.349 177.582 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.581 HG13 HD13 ' B' ' 748' ' ' LEU . 90.4 t -64.04 -45.39 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.981 0.896 . . . . 0.0 109.05 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.81 -35.84 81.21 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.247 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.46 ' NH2' HD22 ' B' ' 704' ' ' LEU . 1.7 ttm105 -59.2 -50.47 73.89 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.822 -1.174 . . . . 0.0 110.393 -178.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.549 HG21 ' HD2' ' C' ' 714' ' ' PRO . 0.6 OUTLIER -78.59 -45.8 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.87 0.843 . . . . 0.0 112.66 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -74.1 -37.55 64.12 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.047 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.492 ' NE2' HD21 ' A' ' 755' ' ' LEU . 7.5 tt0 -102.07 7.37 41.16 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 711' ' ' GLY . . . . . 0.422 ' HA3' HD13 ' B' ' 715' ' ' LEU . . . 76.65 136.01 0.68 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -77.01 -49.63 14.96 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 122.233 -0.569 . . . . 0.0 110.005 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.02 157.43 33.72 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.538 ' CG ' HD21 ' A' ' 748' ' ' LEU . 31.2 Cg_exo -36.31 108.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.102 1.868 . . . . 0.0 114.039 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.422 HD13 ' HA3' ' B' ' 711' ' ' GLY . 3.1 tp -80.11 13.93 2.09 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 27.8 p . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 -179.503 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 121.366 0.603 . . . . 0.0 111.514 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 -71.21 -26.84 63.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.897 -0.502 . . . . 0.0 111.05 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.46 -18.72 7.61 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.89 -0.506 . . . . 0.0 112.038 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -60.52 -39.68 88.66 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.917 -0.489 . . . . 0.0 111.094 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 743' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' B' ' 746' ' ' ILE . 1.0 OUTLIER -59.48 -34.75 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.946 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 744' ' ' ARG . . . . . 0.4 ' C ' ' HD2' ' B' ' 744' ' ' ARG . 0.7 OUTLIER -71.88 -39.4 69.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.191 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.6 m -56.23 -22.79 31.72 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.577 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.611 HG23 HG21 ' A' ' 781' ' ' ILE . 0.6 OUTLIER -52.75 -30.53 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.163 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -63.46 -14.13 47.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.418 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.581 HD13 HG13 ' B' ' 705' ' ' VAL . 55.2 mt -56.13 -40.44 73.78 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 178.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 749' ' ' VAL . . . . . 0.446 HG23 ' O ' ' B' ' 746' ' ' ILE . 0.1 OUTLIER -55.13 -54.12 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -176.549 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.53 -16.11 61.77 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.439 0.638 . . . . 0.0 110.582 175.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -58.13 -21.41 46.34 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 4.4 m -64.48 -44.29 91.49 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.958 -0.731 . . . . 0.0 110.341 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 753' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' B' ' 757' ' ' TRP . 17.2 tp -68.23 -45.98 71.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.056 0.932 . . . . 0.0 109.436 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.75 76.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.5 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 755' ' ' LEU . . . . . 0.482 ' C ' HD23 ' B' ' 755' ' ' LEU . 6.8 tt -58.83 -46.3 88.0 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 121.839 -0.538 . . . . 0.0 110.956 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 44.9 pt -76.2 -30.19 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 121.789 0.804 . . . . 0.0 110.575 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 757' ' ' TRP . . . . . 0.447 ' CZ3' HD11 ' B' ' 753' ' ' LEU . 0.2 OUTLIER -69.25 -30.14 68.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.607 -179.663 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.15 -49.46 77.16 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.593 -0.692 . . . . 0.0 109.148 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.37 -45.33 63.11 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.687 0.756 . . . . 0.0 111.205 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 760' ' ' LEU . . . . . 0.492 ' C ' HD13 ' B' ' 760' ' ' LEU . 3.1 tm? -64.25 -41.67 96.85 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.345 0.593 . . . . 0.0 112.279 -177.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -82.1 -21.26 36.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 48.2 t -74.0 -45.65 48.59 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.448 -0.782 . . . . 0.0 112.151 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.663 ' HA ' HD13 ' B' ' 774' ' ' LEU . 5.9 mp -59.88 -54.94 40.32 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.09 -49.62 4.44 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.722 0.773 . . . . 0.0 112.53 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 72.15 120.85 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.656 0.741 . . . . 0.0 109.986 -178.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 15.1 t80 75.21 -69.19 0.18 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.322 0.649 . . . . 0.0 110.809 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 4.8 m -150.93 176.32 11.21 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.858 -0.526 . . . . 0.0 110.796 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.59 -172.31 0.16 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 78.35 -51.97 0.49 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.683 0.754 . . . . 0.0 108.985 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 15.1 tpt85 -56.62 -29.57 62.33 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.187 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -59.59 -31.99 69.97 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.937 -0.477 . . . . 0.0 109.874 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -57.18 -34.97 69.03 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.54 0.686 . . . . 0.0 109.181 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.01 -46.05 79.34 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.663 HD13 ' HA ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.65 -42.69 88.96 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.524 0.678 . . . . 0.0 109.325 179.179 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.656 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.8 tm? -59.03 -39.0 80.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.317 0.58 . . . . 0.0 110.15 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.63 -42.6 77.82 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 122.129 -0.357 . . . . 0.0 111.276 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 52.2 mt -62.89 -41.48 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.584 HG23 ' O ' ' B' ' 774' ' ' LEU . 64.8 t -61.93 -40.36 86.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.152 0.501 . . . . 0.0 110.097 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.544 ' O ' HG22 ' B' ' 782' ' ' VAL . 9.8 m -62.93 -45.84 90.6 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.013 -0.429 . . . . 0.0 112.02 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.96 72.44 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.542 -0.724 . . . . 0.0 111.846 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.492 HD12 HD13 ' C' ' 746' ' ' ILE . 83.5 mt -68.54 -40.18 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.754 -0.591 . . . . 0.0 111.891 -178.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 779' ' ' THR . 19.5 m -56.39 -38.11 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.362 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -63.25 -42.35 99.18 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.745 0.783 . . . . 0.0 109.742 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 22.8 tp -66.91 -41.57 86.9 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.8 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.409 ' HG ' ' CG ' ' C' ' 750' ' ' ASN . 0.0 OUTLIER -65.29 -35.19 80.25 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.102 0.477 . . . . 0.0 110.631 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -30.49 -51.93 0.21 Allowed Glycine 0 CA--C 1.539 1.535 0 C-N-CA 123.366 0.508 . . . . 0.0 113.04 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.59 85.87 2.44 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 122.214 1.007 . . . . 0.0 109.95 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.901 -1.047 . . . . 0.0 111.004 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.623 HD22 ' CD1' ' B' ' 663' ' ' LEU . 3.9 pp . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 121.902 0.858 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.436 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.9 mp -114.59 151.53 33.29 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.322 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -175.46 174.8 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.278 0.561 . . . . 0.0 110.29 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.455 HD23 ' C ' ' C' ' 663' ' ' LEU . 4.5 tt -49.12 -57.1 7.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.681 0.753 . . . . 0.0 111.942 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.81 -20.7 66.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.265 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -79.18 -46.11 18.57 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.068 0.461 . . . . 0.0 110.962 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -58.5 -45.91 87.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.665 0.745 . . . . 0.0 110.288 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.83 -25.61 64.75 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.298 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 p -64.73 -35.64 81.71 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.276 0.56 . . . . 0.0 110.711 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 29.9 mt -59.91 -30.75 69.25 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.184 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.6 -25.5 64.67 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.963 -0.46 . . . . 0.0 110.857 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -77.79 -27.5 50.21 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.116 0.484 . . . . 0.0 111.277 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.34 -40.63 86.96 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.358 0.599 . . . . 0.0 110.515 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 55.63 32.43 19.23 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.299 0.571 . . . . 0.0 110.985 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -151.53 -69.12 0.17 Allowed 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.646 -0.659 . . . . 0.0 111.953 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.647 HD12 ' CE3' ' C' ' 678' ' ' TRP . 1.6 tp -64.91 -37.6 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 121.83 -0.544 . . . . 0.0 112.053 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.4 m -52.51 -43.12 64.89 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.864 -0.523 . . . . 0.0 111.6 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -57.66 -46.45 84.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.659 0.742 . . . . 0.0 110.13 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.647 ' CE3' HD12 ' C' ' 675' ' ' ILE . 4.3 t90 -65.17 -45.1 86.29 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.167 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 47.4 mt -65.75 -38.96 90.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.388 -0.82 . . . . 0.0 112.698 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -84.3 -42.04 16.22 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.891 -0.505 . . . . 0.0 112.171 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -65.81 -30.02 70.59 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.981 -0.449 . . . . 0.0 112.053 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.725 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.6 pp -62.26 -36.86 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 119.89 -0.724 . . . . 0.0 109.304 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.725 ' N ' HD12 ' C' ' 682' ' ' ILE . 17.6 ttt-85 -59.67 -45.2 92.79 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.1 mm -61.35 -42.81 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.339 1.066 . . . . 0.0 108.65 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.494 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.71 -27.4 66.41 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.031 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.968 HG21 HD12 ' A' ' 686' ' ' ILE . 18.6 mm -60.27 -44.27 95.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.4 -37.74 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 38.4 mm -60.24 -39.29 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.494 HG23 ' O ' ' C' ' 685' ' ' PHE . 84.5 t -55.69 -41.26 64.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 690' ' ' GLY . . . . . 0.401 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.08 -40.48 74.23 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.73 -38.23 83.25 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.824 0.821 . . . . 0.0 110.36 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.482 HD23 HD12 ' B' ' 693' ' ' ILE . 3.1 tp -59.42 -46.56 88.36 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' A' ' 696' ' ' ARG . 2.5 pp -61.3 -41.55 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 121.747 -0.596 . . . . 0.0 109.913 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.713 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -61.02 -34.58 88.46 Favored Glycine 0 CA--C 1.533 1.207 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 4.8 tt -60.75 -38.05 83.86 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.267 1.032 . . . . 0.0 110.214 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.74 ' NE ' HD11 ' B' ' 693' ' ' ILE . 22.6 mmt180 -56.37 -28.33 58.85 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.713 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -58.79 -35.34 55.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 O-C-N 121.329 -0.857 . . . . 0.0 111.248 -176.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.9 p -53.72 -30.82 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.259 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -56.73 -31.58 64.68 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.832 -0.542 . . . . 0.0 110.27 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.94 88.63 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -68.92 -40.42 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.99 -37.56 71.82 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 40.0 m -62.39 -35.61 79.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.532 0.682 . . . . 0.0 109.436 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -41.85 99.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 122.343 1.068 . . . . 0.0 108.19 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.55 -45.36 97.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.458 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -62.79 -36.77 84.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.114 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.404 ' HA ' ' O ' ' C' ' 711' ' ' GLY . 3.0 ttm-85 -62.41 -50.45 71.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.507 -0.746 . . . . 0.0 111.645 -176.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.548 HG23 ' OG ' ' A' ' 713' ' ' SER . 0.4 OUTLIER -77.65 -44.34 29.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.497 0.665 . . . . 0.0 111.714 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -74.31 -43.22 57.65 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 710' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' B' ' 755' ' ' LEU . 0.0 OUTLIER -102.46 -22.06 14.13 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -174.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 711' ' ' GLY . . . . . 0.404 ' O ' ' HA ' ' C' ' 707' ' ' ARG . . . 135.68 -157.92 23.52 Favored Glycine 0 N--CA 1.478 1.441 0 O-C-N 121.317 -0.864 . . . . 0.0 111.675 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -147.47 -50.84 0.19 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.382 -1.069 . . . . 0.0 112.556 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 73.5 m -107.75 159.68 29.49 Favored Pre-proline 0 N--CA 1.463 0.183 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.33 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 714' ' ' PRO . . . . . 0.549 ' HD2' HG21 ' B' ' 708' ' ' VAL . 24.7 Cg_exo -32.97 97.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.226 1.951 . . . . 0.0 112.636 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' C' ' 716' ' ' SER . 6.1 tp -70.71 -20.0 62.7 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 716' ' ' SER . . . . . 0.496 ' C ' ' O ' ' C' ' 715' ' ' LEU . 2.3 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 122.09 0.947 . . . . 0.0 112.52 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 122.337 1.065 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -61.43 -26.4 67.84 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.934 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -21.3 13.6 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.89 -0.506 . . . . 0.0 111.808 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.414 ' HD2' HD12 ' B' ' 774' ' ' LEU . 31.3 mtm180 -74.28 -30.15 61.98 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.948 -0.47 . . . . 0.0 110.952 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -58.93 -44.27 91.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.564 0.697 . . . . 0.0 109.532 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -71.27 -40.37 70.99 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.213 0.53 . . . . 0.0 110.268 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 2.0 m -58.57 -41.97 86.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.843 0.354 . . . . 0.0 110.364 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.492 HD13 HD12 ' B' ' 781' ' ' ILE . 82.9 mt -58.66 -18.6 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 O-C-N 122.073 -0.392 . . . . 0.0 110.031 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -59.61 -33.3 71.3 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.416 HD12 ' CG ' ' A' ' 714' ' ' PRO . 5.2 tt -58.95 -18.78 36.86 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.579 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 749' ' ' VAL . . . . . 0.449 HG23 ' O ' ' C' ' 746' ' ' ILE . 93.9 t -55.69 -55.0 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.409 ' CG ' ' HG ' ' B' ' 785' ' ' LEU . 7.4 m120 -73.58 -20.19 60.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.017 174.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.66 -20.0 30.02 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.193 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 12.6 t -58.21 -37.85 75.62 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.69 -48.78 58.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.66 74.16 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.493 ' C ' HD23 ' C' ' 755' ' ' LEU . 6.9 tt -59.75 -45.55 91.88 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.346 0.593 . . . . 0.0 110.176 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 42.5 mm -66.31 -36.37 77.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.44 0.638 . . . . 0.0 109.632 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.02 -34.12 74.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.03 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 758' ' ' ASP . . . . . 0.441 ' OD1' HD21 ' A' ' 715' ' ' LEU . 54.6 m-20 -56.49 -46.37 80.5 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.979 0.895 . . . . 0.0 109.16 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 759' ' ' ASP . . . . . 0.823 ' O ' HD22 ' C' ' 763' ' ' LEU . 2.9 m-20 -70.4 -45.27 66.29 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.698 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -31.09 69.81 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -80.21 -49.8 11.14 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 11.6 t -65.82 -45.72 81.27 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.823 HD22 ' O ' ' C' ' 759' ' ' ASP . 0.6 OUTLIER -68.31 -37.5 80.66 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -178.142 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.731 ' H ' HD23 ' C' ' 763' ' ' LEU . 83.5 p -98.36 -49.03 4.83 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.621 0.724 . . . . 0.0 111.663 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 2.4 tt 68.4 55.85 0.5 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.454 1.121 . . . . 0.0 109.273 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 766' ' ' PHE . . . . . 0.415 ' C ' ' HG ' ' C' ' 767' ' ' SER . 0.1 OUTLIER 61.11 152.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.451 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 767' ' ' SER . . . . . 0.415 ' HG ' ' C ' ' C' ' 766' ' ' PHE . 0.1 OUTLIER 55.14 116.32 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.548 0.69 . . . . 0.0 111.709 179.899 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -26.63 68.84 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.734 -0.604 . . . . 0.0 110.82 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -65.52 -43.21 90.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.265 1.031 . . . . 0.0 108.293 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -64.72 -29.9 70.9 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.011 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.719 HD12 ' HB3' ' C' ' 764' ' ' SER . 5.0 tt -59.75 -32.21 70.35 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.475 -0.766 . . . . 0.0 110.395 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -38.22 72.78 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.038 -0.414 . . . . 0.0 110.974 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 773' ' ' ASP . . . . . 0.602 ' OD2' HD22 ' C' ' 774' ' ' LEU . 4.9 p30 -68.29 -33.9 75.18 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.286 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.602 HD22 ' OD2' ' C' ' 773' ' ' ASP . 4.0 mm? -60.25 -38.2 82.76 Favored 'General case' 0 C--N 1.353 0.746 0 CA-C-O 121.838 0.827 . . . . 0.0 110.113 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.792 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.2 mm? -58.17 -36.28 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.028 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -32.85 64.49 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.689 -0.632 . . . . 0.0 111.579 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.581 HD12 HD13 ' C' ' 774' ' ' LEU . 8.3 mt -64.87 -37.45 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.356 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.792 HG22 ' O ' ' C' ' 775' ' ' LEU . 4.4 m -55.5 -39.72 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 122.075 -0.391 . . . . 0.0 111.751 -177.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 22.5 m -63.3 -48.21 79.04 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.774 -0.579 . . . . 0.0 110.679 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -31.56 71.98 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.486 0.66 . . . . 0.0 110.486 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.499 HG21 ' HB ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -58.2 -36.62 58.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.579 -179.268 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 747' ' ' ARG . 39.9 t -52.74 -38.82 28.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.579 -0.701 . . . . 0.0 109.148 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.6 -41.65 86.3 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.463 -0.773 . . . . 0.0 111.197 177.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 32.8 tp -65.03 -44.58 88.67 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.591 HD23 ' HB3' ' A' ' 747' ' ' ARG . 47.2 tp -83.38 -21.8 32.95 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.432 -0.793 . . . . 0.0 110.715 -178.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -61.69 -36.89 93.36 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -104.99 136.11 45.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.621 0.725 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.533 -179.647 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 tp . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.424 0.63 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.42 HD22 ' CZ2' ' A' ' 666' ' ' TRP . 23.5 mt 54.37 64.02 1.96 Allowed 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.643 0.735 . . . . 0.0 109.49 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 662' ' ' GLU . . . . . 0.404 ' C ' ' H ' ' A' ' 664' ' ' ASP . 1.5 mm-40 -157.61 73.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.785 HD23 ' N ' ' B' ' 660' ' ' LEU . 2.3 tm? 70.79 -35.4 0.33 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.981 0.912 . . . . 0.0 112.742 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 664' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 662' ' ' GLU . 11.7 t0 -91.56 -37.16 13.28 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.006 0.431 . . . . 0.0 111.758 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -81.38 -31.44 33.3 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.149 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 666' ' ' TRP . . . . . 0.42 ' CZ2' HD22 ' A' ' 661' ' ' LEU . 97.1 m95 -74.46 -39.9 62.23 Favored 'General case' 0 C--N 1.34 0.193 0 O-C-N 121.955 -0.466 . . . . 0.0 111.167 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -76.91 -36.27 56.76 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 57.4 p -58.13 -30.84 66.64 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.165 0.507 . . . . 0.0 110.844 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.514 HD22 ' OG1' ' A' ' 676' ' ' THR . 2.4 mt -63.93 -24.1 67.6 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -64.43 -31.13 72.21 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.83 -0.544 . . . . 0.0 111.107 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -69.45 -30.1 67.94 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.309 0.576 . . . . 0.0 111.032 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -57.48 -48.98 77.77 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.503 0.668 . . . . 0.0 110.374 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 t80 53.96 32.12 14.76 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.72 0.771 . . . . 0.0 110.829 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -146.79 -68.59 0.26 Allowed 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.702 -0.624 . . . . 0.0 111.715 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.665 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.2 OUTLIER -68.16 -39.83 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 CA-C-O 121.418 0.628 . . . . 0.0 111.953 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.514 ' OG1' HD22 ' A' ' 669' ' ' LEU . 17.4 m -52.81 -33.8 50.79 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -62.55 -50.15 72.48 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.874 -0.516 . . . . 0.0 111.783 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.708 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.9 t-105 -65.53 -45.58 82.89 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.649 -0.657 . . . . 0.0 110.379 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.416 HD21 HH11 ' C' ' 683' ' ' ARG . 0.1 OUTLIER -67.22 -35.1 78.87 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -86.29 -11.16 53.0 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.784 -0.573 . . . . 0.0 111.933 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -103.81 -21.87 13.61 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -61.17 -35.46 65.92 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 CA-C-N 120.729 1.604 . . . . 0.0 111.216 179.058 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 16.0 mmm-85 -52.95 -41.52 64.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.799 0.809 . . . . 0.0 109.618 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 88.4 mt -78.52 -40.91 24.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 CA-C-O 122.078 0.942 . . . . 0.0 109.305 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -27.61 68.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.442 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.75 -45.37 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.85 -37.31 71.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.99 -37.55 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.65 -42.7 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 690' ' ' GLY . . . . . 0.458 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -54.74 -38.9 65.41 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.7 m -67.01 -38.85 86.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.697 0.76 . . . . 0.0 109.48 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -46.24 89.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.919 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.687 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.3 OUTLIER -57.9 -41.7 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.837 -179.173 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.93 -31.25 80.18 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.452 ' O ' HG12 ' A' ' 698' ' ' VAL . 2.4 tt -60.03 -40.54 89.69 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.92 0.866 . . . . 0.0 110.031 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.2 mmm180 -55.53 -28.19 53.32 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.88 0.872 . . . . 0.0 112.112 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 45.3 mm -58.05 -35.33 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.52 -0.738 . . . . 0.0 109.624 -177.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.694 ' O ' HG22 ' A' ' 701' ' ' VAL . 3.3 p -54.02 -28.65 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 121.784 -0.572 . . . . 0.0 110.221 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 19.4 m-85 -54.55 -28.48 46.06 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.83 -0.544 . . . . 0.0 110.651 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.94 -37.42 71.49 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.4 m -67.29 -35.95 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -38.2 87.35 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.032 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 69.9 m -67.26 -40.92 86.27 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.248 0.546 . . . . 0.0 109.851 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.776 HD23 ' HD2' ' A' ' 707' ' ' ARG . 13.1 mt -64.91 -42.68 94.53 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-O 121.784 0.802 . . . . 0.0 109.331 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.581 HG23 ' CB ' ' A' ' 748' ' ' LEU . 0.5 OUTLIER -63.56 -41.49 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.948 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 706' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 2.2 m120 -60.93 -44.57 97.04 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.776 ' HD2' HD23 ' A' ' 704' ' ' LEU . 0.0 OUTLIER -64.94 -35.76 82.22 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.853 0.835 . . . . 0.0 110.575 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.0 t -75.59 -45.44 39.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.451 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 709' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -74.89 -14.58 60.67 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 710' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.8 OUTLIER -83.09 6.97 17.25 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.035 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.63 27.8 Favored Glycine 0 CA--C 1.539 1.57 0 O-C-N 122.024 -0.422 . . . . 0.0 113.17 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.6 -143.41 0.45 Allowed 'General case' 0 CA--C 1.56 1.351 0 O-C-N 121.738 -0.86 . . . . 0.0 110.435 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.468 ' HB2' HG21 ' C' ' 708' ' ' VAL . 81.7 p -62.12 159.7 36.32 Favored Pre-proline 0 C--N 1.351 0.667 0 O-C-N 121.293 -0.88 . . . . 0.0 110.682 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -41.57 104.56 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.585 1.523 . . . . 0.0 112.576 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.611 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.1 pt? -108.82 -20.57 13.02 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -177.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 121.536 0.684 . . . . 0.0 110.682 -179.442 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.311 1.053 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -57.93 -25.09 60.44 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.873 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.34 -9.86 0.33 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -175.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.65 -31.86 70.19 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.366 -0.834 . . . . 0.0 109.151 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -69.59 -45.06 69.5 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -71.11 -31.8 68.22 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.839 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 84.2 p -61.31 -42.57 98.89 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.718 HG22 HD13 ' C' ' 781' ' ' ILE . 48.3 mt -57.65 -16.49 5.81 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -58.46 -25.28 62.09 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.96 -1.088 . . . . 0.0 108.87 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 748' ' ' LEU . 0.5 OUTLIER -60.49 -14.76 21.32 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -54.33 -54.18 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.725 0 CA-C-N 121.4 1.909 . . . . 0.0 105.882 178.784 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -72.81 -20.43 61.14 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.074 -1.875 . . . . 0.0 110.993 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -57.31 -20.96 38.5 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.04 -178.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 7.2 m -61.46 -40.56 94.95 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.887 -0.772 . . . . 0.0 110.084 179.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.6 -50.87 40.4 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.56 0.695 . . . . 0.0 109.802 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.18 -34.83 78.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.176 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.501 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.4 tt -59.5 -45.44 91.69 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.904 -0.497 . . . . 0.0 110.619 -177.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.0 mm -64.93 -34.8 72.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.725 0.774 . . . . 0.0 109.326 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -33.93 75.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.627 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.444 ' OD1' HD23 ' B' ' 715' ' ' LEU . 3.7 m-20 -57.26 -43.05 82.67 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.353 -0.842 . . . . 0.0 109.343 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -70.35 -44.33 68.38 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.664 0.745 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.522 ' HA ' HD11 ' A' ' 763' ' ' LEU . 12.9 mt -65.08 -32.55 74.31 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.651 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -82.39 -22.55 35.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -46.94 24.44 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.321 -0.862 . . . . 0.0 111.675 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -69.13 -53.4 20.38 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.514 -0.741 . . . . 0.0 111.899 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 764' ' ' SER . . . . . 0.471 ' H ' HD12 ' A' ' 763' ' ' LEU . 10.0 p -97.79 -49.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.482 -0.761 . . . . 0.0 112.454 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.449 ' O ' HD23 ' A' ' 765' ' ' LEU . 0.6 OUTLIER 75.94 -7.64 1.77 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.984 0.514 . . . . 0.0 111.036 -178.001 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -174.95 121.42 0.22 Allowed 'General case' 0 C--N 1.347 0.493 0 O-C-N 121.346 -0.846 . . . . 0.0 110.985 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 67.1 m 48.96 -96.71 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.402 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.781 ' CE1' HD23 ' A' ' 771' ' ' LEU . 21.7 t80 -166.68 -21.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.243 -0.911 . . . . 0.0 112.252 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -52.43 -37.44 56.8 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.406 0.622 . . . . 0.0 110.385 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -70.31 -30.59 67.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.372 0.606 . . . . 0.0 111.029 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.781 HD23 ' CE1' ' A' ' 768' ' ' TYR . 0.2 OUTLIER -60.61 -34.2 73.88 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.234 0.54 . . . . 0.0 109.926 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 -41.78 77.87 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -65.76 -34.48 78.27 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.976 HD22 HD11 ' A' ' 777' ' ' ILE . 0.4 OUTLIER -58.24 -38.81 77.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.337 0.589 . . . . 0.0 110.489 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 775' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 778' ' ' VAL . 6.6 tp -59.52 -36.96 77.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.235 0.54 . . . . 0.0 112.239 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 776' ' ' LEU . . . . . 0.519 ' C ' HD13 ' A' ' 776' ' ' LEU . 2.4 tm? -74.69 -42.45 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.631 -0.668 . . . . 0.0 111.634 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.976 HD11 HD22 ' A' ' 774' ' ' LEU . 29.2 pt -65.21 -35.93 76.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.502 ' O ' ' HB ' ' A' ' 781' ' ' ILE . 17.5 m -54.55 -38.95 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.954 0.797 . . . . 0.0 110.171 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 17.8 p -63.07 -35.91 81.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 118.447 -1.301 . . . . 0.0 108.041 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -32.01 72.31 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.681 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 746' ' ' ILE . 0.7 OUTLIER -57.54 -55.7 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.4 m -64.35 -38.89 83.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.594 0.711 . . . . 0.0 111.066 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.15 -41.64 97.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.602 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.91 -43.42 83.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.223 0.535 . . . . 0.0 111.231 -178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.442 HD23 ' OD1' ' B' ' 750' ' ' ASN . 2.0 tp -87.38 -12.91 44.9 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.966 0.412 . . . . 0.0 112.035 -179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -63.17 -39.67 98.22 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 25.8 ptt85 -76.96 151.04 35.85 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.335 0.588 . . . . 0.0 110.809 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.468 0.459 0 CA-C-O 117.847 -1.073 . . . . 0.0 110.722 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.785 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.6 tp . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.453 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.9 mm? 58.05 106.31 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.315 0.579 . . . . 0.0 110.196 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.15 177.97 4.6 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.939 0.876 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.498 ' C ' HD23 ' B' ' 663' ' ' LEU . 10.1 tt -46.19 -53.76 9.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.691 0.758 . . . . 0.0 111.48 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -65.41 -29.61 70.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.578 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -76.45 -44.4 35.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.913 0.387 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -59.08 -46.1 89.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.634 0.73 . . . . 0.0 110.085 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.08 -21.64 66.61 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.228 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 4.9 m -70.35 -36.25 74.09 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.822 -0.549 . . . . 0.0 111.217 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.581 HD12 ' CG2' ' B' ' 675' ' ' ILE . 3.5 mm? -60.74 -23.82 65.24 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.992 -0.443 . . . . 0.0 111.196 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -59.86 -23.02 63.07 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.764 -0.585 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -88.14 -27.73 21.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.123 0.487 . . . . 0.0 111.265 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -57.44 -50.87 71.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.528 0.68 . . . . 0.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.64 29.94 14.99 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.136 0.494 . . . . 0.0 111.269 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -144.11 -61.47 0.39 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.671 -0.643 . . . . 0.0 111.075 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.581 ' CG2' HD12 ' B' ' 669' ' ' LEU . 5.9 tp -67.92 -37.78 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 121.323 0.582 . . . . 0.0 110.33 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.8 m -52.98 -34.55 56.56 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.758 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -69.16 -50.47 47.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.886 -0.509 . . . . 0.0 111.368 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.74 -42.17 95.4 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.0 tp -65.97 -35.74 81.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.94 0.4 . . . . 0.0 110.859 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -101.27 6.56 42.92 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.58 -21.15 9.29 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 121.71 -0.619 . . . . 0.0 110.471 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 tp -62.16 -35.53 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.771 0.796 . . . . 0.0 109.982 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -53.21 -47.36 69.0 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.622 -0.674 . . . . 0.0 109.972 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.443 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.8 mp -69.21 -37.91 76.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 122.246 1.022 . . . . 0.0 108.394 177.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' B' ' 689' ' ' VAL . 11.9 t80 -59.73 -33.89 72.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.674 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.5 ' CG2' HD12 ' C' ' 686' ' ' ILE . 1.4 mp -60.49 -41.98 89.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 86.2 mt -62.41 -36.95 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.15 -37.54 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.529 ' O ' HD11 ' B' ' 692' ' ' LEU . 93.3 t -54.12 -38.79 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 O-C-N 121.723 -0.611 . . . . 0.0 109.447 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.64 -27.15 57.61 Favored Glycine 0 CA--C 1.546 1.995 0 O-C-N 121.902 -0.499 . . . . 0.0 112.078 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.7 m -60.77 -47.12 87.76 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.613 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.7 -32.59 70.65 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.528 -0.733 . . . . 0.0 111.482 -178.004 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.613 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.37 -41.66 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 O-C-N 121.605 -0.684 . . . . 0.0 109.662 -178.527 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.94 -32.17 83.34 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.84 -37.08 63.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.3 1.048 . . . . 0.0 109.345 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.63 ' HG3' HD11 ' A' ' 693' ' ' ILE . 26.6 mmt180 -55.58 -28.28 54.12 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.692 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 79.2 mt -58.77 -36.21 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 O-C-N 121.423 -0.798 . . . . 0.0 108.914 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -30.29 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 O-C-N 121.674 -0.641 . . . . 0.0 110.123 177.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 5.5 m-85 -56.36 -31.01 63.38 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 121.828 -0.545 . . . . 0.0 109.871 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.89 -37.57 76.89 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.86 -40.59 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.167 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 176.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.3 tp -55.6 -37.21 67.82 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.975 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.5 m -62.37 -40.77 97.51 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.178 0.513 . . . . 0.0 110.821 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.78 -41.05 94.79 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.069 0.938 . . . . 0.0 109.265 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.649 ' HA ' HD13 ' B' ' 748' ' ' LEU . 89.8 t -69.68 -43.57 80.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.556 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HB2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.77 -36.41 82.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.078 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -67.19 -47.75 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.151 -0.968 . . . . 0.0 110.375 -178.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.555 ' CG1' HD11 ' B' ' 748' ' ' LEU . 2.6 t -77.12 -46.29 28.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -73.8 -43.17 59.63 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' B' ' 706' ' ' ASN . 31.5 mt-30 -102.01 -21.58 14.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -175.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 711' ' ' GLY . . . . . 0.444 ' HA3' HD11 ' B' ' 715' ' ' LEU . . . 109.43 136.32 7.53 Favored Glycine 0 CA--C 1.534 1.235 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 712' ' ' TYR . . . . . 0.679 ' O ' HD22 ' A' ' 704' ' ' LEU . 2.1 p90 -75.4 -67.89 0.61 Allowed 'General case' 0 CA--C 1.557 1.24 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 1.7 p -65.54 159.6 66.42 Favored Pre-proline 0 N--CA 1.47 0.535 0 O-C-N 120.628 -1.295 . . . . 0.0 110.516 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -37.57 133.11 0.62 Allowed 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.996 1.798 . . . . 0.0 111.847 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.516 HD22 ' N ' ' B' ' 715' ' ' LEU . 2.0 mm? -94.16 -20.35 19.95 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.503 ' C ' ' O ' ' B' ' 715' ' ' LEU . 97.3 p . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 122.279 1.037 . . . . 0.0 112.819 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 121.47 0.653 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -71.03 -26.61 63.18 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.298 0.57 . . . . 0.0 111.284 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -56.23 -7.03 0.31 Allowed 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.447 ' O ' HG13 ' B' ' 746' ' ' ILE . 3.6 ttm180 -55.73 -38.99 70.51 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.515 -0.741 . . . . 0.0 110.912 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -58.54 -43.94 89.45 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.339 0.59 . . . . 0.0 109.664 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -71.42 -39.78 70.87 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.141 0.496 . . . . 0.0 110.468 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.84 -23.76 46.32 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.982 HG23 HG23 ' A' ' 781' ' ' ILE . 48.6 mt -52.43 -32.47 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.36 67.57 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.165 0.507 . . . . 0.0 110.452 179.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.649 HD13 ' HA ' ' B' ' 705' ' ' VAL . 45.4 mt -56.24 -35.7 67.67 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.497 0.555 . . . . 0.0 112.497 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.48 -54.11 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 750' ' ' ASN . . . . . 0.442 ' OD1' HD23 ' A' ' 785' ' ' LEU . 9.2 m120 -72.46 -18.77 61.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.668 0.746 . . . . 0.0 110.073 175.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.4 37.26 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.377 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 83.8 p -59.21 -39.65 83.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 117.787 0.793 . . . . 0.0 110.052 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.0 tp -69.66 -51.17 37.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.8 0.81 . . . . 0.0 109.649 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.13 73.27 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.408 0.623 . . . . 0.0 111.366 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 755' ' ' LEU . . . . . 0.461 ' C ' HD23 ' B' ' 755' ' ' LEU . 10.5 tt -59.76 -45.2 92.97 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 120.976 0.417 . . . . 0.0 110.787 -178.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 53.7 mt -70.4 -33.7 55.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.5 0.667 . . . . 0.0 109.55 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.1 -30.28 68.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.754 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -55.61 -47.97 75.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.409 -0.807 . . . . 0.0 110.086 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -70.73 -45.25 65.22 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.1 mt -69.23 -46.28 67.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.653 0.74 . . . . 0.0 112.535 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -69.06 -40.12 78.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.682 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 15.4 t -63.92 -45.1 90.77 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.911 0.862 . . . . 0.0 110.599 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.612 ' O ' HD22 ' B' ' 774' ' ' LEU . 3.6 tp -63.83 -51.84 62.88 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.872 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.1 -49.23 5.07 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.878 -0.514 . . . . 0.0 111.922 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 765' ' ' LEU . . . . . 0.536 HD13 ' O ' ' B' ' 765' ' ' LEU . 3.4 tm? 69.45 93.54 0.08 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 122.22 1.009 . . . . 0.0 109.81 -178.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 58.6 t80 56.54 -88.51 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.915 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.2 m -67.96 134.76 51.31 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.283 -0.886 . . . . 0.0 111.246 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.6 -33.95 69.46 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.001 0.429 . . . . 0.0 109.981 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -54.46 -38.49 66.43 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.154 0.978 . . . . 0.0 108.956 178.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.85 -29.6 60.12 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.452 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.426 HD11 HD23 ' B' ' 763' ' ' LEU . 7.3 tt -59.25 -41.28 88.39 Favored 'General case' 0 C--N 1.343 0.296 0 O-C-N 121.794 -0.566 . . . . 0.0 109.841 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 772' ' ' ARG . . . . . 0.407 ' O ' HD12 ' B' ' 776' ' ' LEU . 70.8 mtp85 -59.95 -39.47 85.67 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -64.22 -45.65 87.31 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.235 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.612 HD22 ' O ' ' B' ' 763' ' ' LEU . 5.9 mp -66.6 -37.8 85.65 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 121.835 0.826 . . . . 0.0 110.262 178.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.527 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -62.83 -36.65 83.92 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.646 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 776' ' ' LEU . . . . . 0.407 HD12 ' O ' ' B' ' 772' ' ' ARG . 0.3 OUTLIER -73.67 -42.21 61.64 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.848 -0.533 . . . . 0.0 111.996 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 777' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.89 -37.44 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 121.634 -0.666 . . . . 0.0 110.468 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 13.1 p -63.32 -44.99 99.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.886 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.775 ' O ' HG22 ' B' ' 782' ' ' VAL . 7.2 t -64.06 -35.72 81.67 Favored 'General case' 0 C--N 1.351 0.642 0 O-C-N 121.577 -0.702 . . . . 0.0 111.125 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -31.47 71.94 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.983 -0.448 . . . . 0.0 111.622 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 76.5 mt -67.88 -36.78 76.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 O-C-N 121.759 -0.588 . . . . 0.0 110.907 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.775 HG22 ' O ' ' B' ' 779' ' ' THR . 6.9 m -61.07 -39.0 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.852 -0.53 . . . . 0.0 111.984 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.4 -41.58 93.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.628 -0.67 . . . . 0.0 111.043 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.0 -42.17 99.78 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.619 0.723 . . . . 0.0 110.174 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.433 HD23 ' HB3' ' C' ' 750' ' ' ASN . 15.0 tp -82.36 -17.38 45.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.413 0.625 . . . . 0.0 111.624 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.37 -46.09 22.22 Favored Glycine 0 CA--C 1.531 1.074 0 O-C-N 121.797 -0.564 . . . . 0.0 112.16 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 95.5 5.29 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.488 0.661 . . . . 0.0 110.524 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.127 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.499 HD12 ' C ' ' C' ' 660' ' ' LEU . 4.0 pp . . . . . 0 N--CA 1.496 1.827 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.0 143.28 50.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.267 0.556 . . . . 0.0 110.63 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -172.44 176.44 3.3 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.086 0.469 . . . . 0.0 110.05 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 20.7 tp -54.59 -44.0 72.64 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.767 0.794 . . . . 0.0 109.957 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.88 -33.52 76.22 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.778 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -79.19 -40.32 31.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.185 0.517 . . . . 0.0 110.736 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -70.78 -46.33 63.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 110.318 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.72 -22.26 66.59 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.442 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 36.3 t -68.1 -35.56 78.36 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.1 0.476 . . . . 0.0 111.441 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -34.47 73.35 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.117 0.484 . . . . 0.0 111.197 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 64.9 m95 -59.83 -27.93 67.04 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.117 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -77.73 -20.1 54.07 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.081 -0.387 . . . . 0.0 112.033 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -67.46 -45.07 77.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.673 0.749 . . . . 0.0 110.348 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 53.89 29.26 9.6 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.028 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.05 -75.8 0.24 Allowed 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.49 -0.756 . . . . 0.0 112.497 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.674 HD13 ' CZ3' ' C' ' 678' ' ' TRP . 0.6 OUTLIER -68.23 -36.67 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.62 -0.675 . . . . 0.0 111.221 -178.571 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 25.3 m -51.62 -33.09 31.58 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.16 -0.337 . . . . 0.0 110.963 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -56.33 -47.89 77.85 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.674 ' CZ3' HD13 ' C' ' 675' ' ' ILE . 0.0 OUTLIER -64.87 -43.43 92.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 177.789 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.51 ' O ' HD23 ' C' ' 679' ' ' LEU . 0.9 OUTLIER -58.87 -40.14 83.49 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.33 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -97.71 -40.39 8.6 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -69.18 -19.79 63.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.704 -0.623 . . . . 0.0 112.015 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.67 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.2 pp -60.63 -36.7 72.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.67 ' N ' HD12 ' C' ' 682' ' ' ILE . 1.6 ttt-85 -53.69 -45.21 70.29 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 121.861 0.839 . . . . 0.0 109.023 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.3 mm -62.38 -43.13 97.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 122.4 1.095 . . . . 0.0 108.898 177.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.534 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.7 OUTLIER -60.47 -27.59 67.67 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.125 -178.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.5 HD12 ' CG2' ' B' ' 686' ' ' ILE . 16.5 mm -60.11 -46.48 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.974 -0.454 . . . . 0.0 109.889 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.02 -41.4 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.511 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.2 mt -59.79 -37.59 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.951 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.534 HG23 ' O ' ' C' ' 685' ' ' PHE . 79.6 t -54.78 -45.32 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.33 -38.76 62.96 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -37.93 84.65 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 122.09 0.948 . . . . 0.0 109.824 177.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.23 -46.29 88.87 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 113.166 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -61.3 -41.82 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.401 -0.812 . . . . 0.0 109.415 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.95 73.15 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.407 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.4 tt -54.87 -37.66 66.55 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.559 -0.965 . . . . 0.0 110.196 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.91 -28.68 57.89 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 -177.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -36.85 62.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-N 121.338 1.881 . . . . 0.0 111.183 -175.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.4 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.8 p -62.55 -30.26 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.448 -0.782 . . . . 0.0 111.014 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -56.29 -31.12 63.36 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.75 -0.594 . . . . 0.0 110.04 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.18 -37.79 78.24 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -43.64 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tp -61.24 -37.71 84.06 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.209 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 61.9 m -62.52 -36.23 81.94 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.374 0.607 . . . . 0.0 110.371 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -62.91 -47.01 85.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.483 1.135 . . . . 0.0 108.494 178.544 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.72 -44.26 98.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.783 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -62.57 -35.79 80.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.281 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -61.32 -50.28 73.59 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.473 -0.767 . . . . 0.0 110.655 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' A' ' 713' ' ' SER . 0.6 OUTLIER -77.33 -45.02 30.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.824 0.821 . . . . 0.0 111.782 -178.557 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -73.83 -33.37 64.12 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -102.17 -15.49 16.65 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -177.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 91.83 133.73 6.12 Favored Glycine 0 CA--C 1.542 1.751 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -87.7 -36.72 17.23 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.764 -0.845 . . . . 0.0 113.102 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.53 149.35 35.65 Favored Pre-proline 0 N--CA 1.469 0.483 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.961 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 714' ' ' PRO . . . . . 0.443 ' CD ' HG21 ' B' ' 708' ' ' VAL . 16.9 Cg_exo -36.71 92.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.501 2.134 . . . . 0.0 112.704 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.97 11.03 1.94 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.492 0.663 . . . . 0.0 110.903 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -72.67 -38.31 67.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.328 0.585 . . . . 0.0 111.528 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.57 -7.49 53.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.493 ' O ' HD12 ' C' ' 746' ' ' ILE . 0.0 OUTLIER -65.87 -35.34 80.38 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.695 -0.628 . . . . 0.0 111.411 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -58.04 -41.19 82.74 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 109.786 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.4 68.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-O 121.214 0.531 . . . . 0.0 110.496 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 745' ' ' SER . . . . . 0.585 ' O ' HD22 ' C' ' 748' ' ' LEU . 83.8 p -67.04 -43.09 83.64 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.637 -0.665 . . . . 0.0 110.178 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.493 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.8 mp -55.43 -23.9 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.945 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -60.01 -15.64 24.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.885 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.585 HD22 ' O ' ' C' ' 745' ' ' SER . 1.5 pt? -55.38 -31.77 62.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.972 -0.455 . . . . 0.0 110.949 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.7 t -55.73 -54.9 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.433 ' HB3' HD23 ' B' ' 785' ' ' LEU . 2.0 p-10 -72.39 -23.63 61.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.766 0.793 . . . . 0.0 109.761 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.75 -21.76 44.74 Favored Glycine 0 C--N 1.342 0.899 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.012 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 19.3 m -63.07 -42.24 99.62 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.943 -0.739 . . . . 0.0 109.894 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.7 tp -69.32 -44.86 70.85 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.422 0.63 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.78 -35.63 79.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.872 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.447 HD11 ' HG ' ' C' ' 704' ' ' LEU . 8.8 tt -61.33 -45.3 95.02 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.216 0.531 . . . . 0.0 111.241 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 44.7 mm -71.67 -40.99 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.118 0.485 . . . . 0.0 110.38 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.56 -41.11 76.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -55.84 -35.89 66.92 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.346 -0.847 . . . . 0.0 110.54 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -70.37 -45.47 66.0 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.762 0.791 . . . . 0.0 111.156 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 20.8 mt -69.61 -46.07 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.676 0.75 . . . . 0.0 112.249 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 761' ' ' ARG . . . . . 0.542 ' O ' HD13 ' C' ' 765' ' ' LEU . 1.5 ttp180 -68.81 -27.5 65.92 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.543 -177.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.9 m -63.96 -43.96 94.22 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.447 0.641 . . . . 0.0 111.173 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.73 -54.66 14.76 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 3.0 p -97.86 -18.26 18.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 765' ' ' LEU . . . . . 0.545 HD22 ' N ' ' C' ' 765' ' ' LEU . 3.3 mm? 49.67 78.86 0.09 Allowed 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.393 -0.817 . . . . 0.0 109.744 -177.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 69.9 t80 65.9 125.0 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.234 1.016 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 23.06 88.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 178.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 768' ' ' TYR . . . . . 0.437 ' CZ ' HD22 ' C' ' 771' ' ' LEU . 1.1 m-85 22.63 -146.72 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.759 1.223 . . . . 0.0 114.028 176.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 74.26 -64.56 0.38 Allowed 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.201 -0.937 . . . . 0.0 109.398 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.26 69.77 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.098 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' C' ' 768' ' ' TYR . 39.1 tp -59.48 -36.93 76.96 Favored 'General case' 0 C--N 1.348 0.543 0 O-C-N 121.803 -0.561 . . . . 0.0 109.731 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -42.96 82.17 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 773' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' C' ' 776' ' ' LEU . 23.6 m-20 -69.38 -34.4 74.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.556 176.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.524 HD13 ' C ' ' C' ' 774' ' ' LEU . 3.3 tm? -61.08 -41.2 96.21 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.749 -0.594 . . . . 0.0 110.868 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.45 -38.3 83.74 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 776' ' ' LEU . . . . . 0.464 HD12 ' N ' ' C' ' 777' ' ' ILE . 3.3 pp -74.01 -28.45 61.45 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.656 -0.652 . . . . 0.0 111.822 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.464 ' N ' HD12 ' C' ' 776' ' ' LEU . 0.6 OUTLIER -69.26 -39.14 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 O-C-N 121.467 -0.77 . . . . 0.0 110.682 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.702 ' O ' HG22 ' C' ' 781' ' ' ILE . 12.3 m -66.36 -46.35 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.877 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.849 ' O ' HG22 ' C' ' 782' ' ' VAL . 9.8 t -64.21 -37.5 87.71 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.974 -0.454 . . . . 0.0 111.815 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.6 72.59 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.148 -0.345 . . . . 0.0 111.567 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.718 HD13 HG22 ' A' ' 746' ' ' ILE . 8.9 tt -55.03 -39.95 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.546 -0.721 . . . . 0.0 111.233 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.849 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -60.16 -38.29 76.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.276 -0.569 . . . . 0.0 111.917 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -64.51 -45.21 88.21 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.708 -0.62 . . . . 0.0 111.531 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 784' ' ' LEU . . . . . 0.459 ' C ' HD12 ' C' ' 784' ' ' LEU . 0.3 OUTLIER -70.29 -36.52 74.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.653 0.74 . . . . 0.0 109.997 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 785' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.64 -36.88 85.68 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.201 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.61 -34.0 9.53 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -102.27 151.91 21.67 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 122.116 -0.637 . . . . 0.0 110.209 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.254 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.663 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.5 tp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.755 0.788 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 76.0 mt 52.75 81.03 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.046 0.927 . . . . 0.0 111.209 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.75 177.82 8.44 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.67 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.3 OUTLIER -54.41 -34.38 61.22 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.253 0.549 . . . . 0.0 110.15 179.444 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -75.79 -35.54 60.04 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -80.1 -41.2 26.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.259 0.552 . . . . 0.0 110.676 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -67.96 -43.62 78.62 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.298 0.57 . . . . 0.0 110.281 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.54 -29.52 63.65 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.722 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 36.7 t -69.77 -30.56 68.16 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 110.745 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.423 HD23 HG23 ' A' ' 676' ' ' THR . 17.8 tp -61.02 -31.5 71.13 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.843 0.354 . . . . 0.0 111.173 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.58 -18.3 39.98 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.921 -0.487 . . . . 0.0 111.702 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -84.02 -16.08 45.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.921 -0.487 . . . . 0.0 111.807 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.6 -50.22 74.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.341 0.591 . . . . 0.0 110.88 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 55.3 t80 56.55 44.42 24.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.005 0.907 . . . . 0.0 110.982 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -153.59 -80.61 0.09 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.8 -0.562 . . . . 0.0 110.561 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 11.2 tt -68.13 -35.71 72.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.841 -0.537 . . . . 0.0 111.973 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.423 HG23 HD23 ' A' ' 669' ' ' LEU . 4.1 m -50.22 -33.34 19.13 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -174.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -63.26 -50.42 70.23 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.331 0.969 . . . . 0.0 109.001 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.411 ' CD1' ' C ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -66.07 -44.37 84.72 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.577 0.704 . . . . 0.0 110.123 177.787 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.425 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -63.67 -37.08 86.0 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -92.11 -44.51 8.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -73.38 -0.82 15.89 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.44 -36.37 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 121.296 -0.878 . . . . 0.0 109.622 178.288 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -53.77 -47.58 70.57 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.96 0.41 . . . . 0.0 110.874 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -68.43 -31.98 53.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -33.61 76.19 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 1.036 HD12 HG21 ' C' ' 686' ' ' ILE . 8.9 mm -60.83 -49.51 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 109.991 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.0 mt -61.48 -38.5 80.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.09 -37.16 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.245 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 74.9 t -54.2 -39.65 43.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.7 -41.73 97.6 Favored Glycine 0 CA--C 1.534 1.24 0 N-CA-C 108.961 -1.655 . . . . 0.0 108.961 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -61.77 -37.9 86.04 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.777 0.798 . . . . 0.0 109.766 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.88 -46.09 88.65 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.879 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.624 HG13 HG22 ' B' ' 693' ' ' ILE . 0.3 OUTLIER -68.38 -40.1 81.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.538 179.538 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -26.73 64.07 Favored Glycine 0 CA--C 1.54 1.652 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.41 -37.33 85.39 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.691 1.234 . . . . 0.0 109.332 177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 21.5 mmt180 -55.9 -28.31 56.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.019 -178.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.1 OUTLIER -59.25 -37.12 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.03 -1.043 . . . . 0.0 109.869 -177.225 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.774 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.1 p -67.41 -30.57 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 121.547 -0.721 . . . . 0.0 109.952 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.3 OUTLIER -55.55 -28.79 56.94 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.232 0.539 . . . . 0.0 109.713 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.06 72.01 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.774 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -61.01 -35.93 68.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -38.0 72.81 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.0 m -64.18 -36.7 84.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.748 0.785 . . . . 0.0 109.707 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.569 HD22 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -61.98 -44.11 97.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 122.495 1.14 . . . . 0.0 108.636 178.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.888 HG22 HD12 ' A' ' 748' ' ' LEU . 88.0 t -65.45 -42.03 92.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.484 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -62.61 -37.08 84.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.574 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.569 HH22 HD22 ' A' ' 704' ' ' LEU . 21.4 ttm105 -61.59 -46.93 87.77 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.096 0.951 . . . . 0.0 110.334 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.3 t -75.77 -44.04 39.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.15 0.976 . . . . 0.0 109.833 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.88 -14.89 61.58 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -96.5 -20.69 18.2 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.297 -0.877 . . . . 0.0 111.962 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.9 24.96 7.03 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.416 ' CD1' ' CZ ' ' C' ' 707' ' ' ARG . 0.1 OUTLIER 59.07 -103.55 0.17 Allowed 'General case' 0 CA--C 1.562 1.406 0 O-C-N 121.956 -0.732 . . . . 0.0 111.559 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 2.2 p -79.39 159.52 72.2 Favored Pre-proline 0 C--N 1.349 0.558 0 O-C-N 120.931 -1.106 . . . . 0.0 110.013 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.511 ' HD3' HD12 ' C' ' 748' ' ' LEU . 72.2 Cg_exo -41.72 110.82 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.574 1.516 . . . . 0.0 112.514 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.94 -18.97 13.56 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 122.072 -0.392 . . . . 0.0 111.797 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.546 0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 111.044 -179.802 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.77 0.795 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -26.52 62.38 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.69 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -13.48 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.603 HH11 HG21 ' C' ' 777' ' ' ILE . 20.0 ttp-105 -73.79 -46.82 43.08 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.358 -0.839 . . . . 0.0 110.148 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.468 ' O ' HG23 ' C' ' 781' ' ' ILE . 1.3 p30 -62.79 -34.68 77.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 122.52 1.152 . . . . 0.0 109.645 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 744' ' ' ARG . . . . . 0.669 ' O ' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -71.8 -37.87 70.34 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.645 179.033 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.3 t -70.02 -39.7 75.65 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.626 -0.671 . . . . 0.0 112.654 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.797 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -66.36 -41.26 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-O 116.367 -1.778 . . . . 0.0 115.28 -176.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.752 ' HB3' HD23 ' C' ' 785' ' ' LEU . 1.6 tmt_? -78.37 -11.51 59.95 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 123.568 2.895 . . . . 0.0 109.212 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.888 HD12 HG22 ' A' ' 705' ' ' VAL . 3.5 tm? -55.78 -20.54 15.32 Favored 'General case' 0 C--N 1.375 1.698 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 172.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.8 p -54.67 -50.41 60.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 177.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.447 ' HB2' ' HD3' ' A' ' 747' ' ' ARG . 4.6 m120 -71.99 -28.17 63.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.522 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.4 -18.65 22.92 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.409 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 77.6 p -56.63 -36.77 69.85 Favored 'General case' 0 C--N 1.347 0.458 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 33.7 tp -61.53 -47.96 83.19 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.74 -34.59 71.54 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.768 178.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.46 HD22 HG12 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -59.01 -44.68 91.72 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.725 -0.61 . . . . 0.0 111.38 -177.414 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.36 -32.63 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.43 -30.67 68.65 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.019 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 4.4 m-20 -58.02 -46.99 84.4 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.94 0.876 . . . . 0.0 108.814 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.71 -42.24 70.86 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.505 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 19.3 mt -68.25 -33.39 74.3 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -70.65 -27.43 64.03 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 762' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 m -75.82 -45.35 36.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.544 0.688 . . . . 0.0 110.819 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.64 ' HA ' HD13 ' A' ' 774' ' ' LEU . 7.0 mp -68.5 -56.79 7.16 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.41 -49.53 4.21 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.085 0.945 . . . . 0.0 112.301 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.467 ' C ' HD13 ' A' ' 765' ' ' LEU . 2.9 tm? 91.32 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.354 1.462 . . . . 0.0 110.626 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -114.11 -68.07 0.95 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.648 -0.657 . . . . 0.0 111.266 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 24.8 p -91.45 158.8 16.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -78.31 -18.26 55.46 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.122 0.487 . . . . 0.0 111.015 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -72.36 -35.3 68.48 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.589 0.709 . . . . 0.0 109.345 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -57.85 -30.02 65.45 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.243 0.544 . . . . 0.0 110.68 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -34.82 73.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -56.84 -37.58 71.47 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.599 0.714 . . . . 0.0 109.582 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.31 -48.58 72.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.83 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.683 HD12 ' NE ' ' B' ' 742' ' ' ARG . 5.8 tt -60.52 -38.48 84.53 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.653 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.59 -36.97 74.83 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.4 -0.813 . . . . 0.0 110.641 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.23 -45.31 48.91 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.99 -0.444 . . . . 0.0 112.069 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.31 -37.25 79.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.685 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.447 HG22 HG12 ' B' ' 746' ' ' ILE . 38.5 t -56.28 -46.79 81.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.795 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.2 p -64.13 -35.37 80.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.606 0.717 . . . . 0.0 109.854 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -65.3 -38.4 90.08 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.129 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.407 ' CD1' HD13 ' B' ' 746' ' ' ILE . 78.4 mt -59.29 -37.07 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 O-C-N 122.078 -0.389 . . . . 0.0 111.399 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.795 HG22 ' O ' ' A' ' 779' ' ' THR . 5.7 m -54.39 -38.34 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 121.331 -0.856 . . . . 0.0 110.431 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -64.57 -42.51 95.61 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.399 0.619 . . . . 0.0 110.768 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.22 -43.94 69.63 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.399 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.461 HD21 ' HG3' ' B' ' 747' ' ' ARG . 0.1 OUTLIER -69.84 -21.86 63.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.861 -0.525 . . . . 0.0 111.057 -179.201 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -43.4 -28.2 0.9 Allowed Glycine 0 CA--C 1.538 1.482 0 O-C-N 122.13 -0.356 . . . . 0.0 112.237 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 152.17 24.71 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.022 -0.693 . . . . 0.0 110.779 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 118.027 -0.987 . . . . 0.0 111.488 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.67 ' N ' HD12 ' A' ' 663' ' ' LEU . 10.6 mt . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.564 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.4 mm? 60.25 110.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.342 0.591 . . . . 0.0 110.239 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -177.2 169.4 2.29 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.633 HD12 HD13 ' C' ' 660' ' ' LEU . 3.4 tt -51.21 -38.6 53.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.402 0.62 . . . . 0.0 110.552 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -70.96 -37.16 72.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.336 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -70.31 -47.85 59.3 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.364 0.602 . . . . 0.0 110.775 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -60.22 -45.4 93.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.435 0.636 . . . . 0.0 110.182 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.8 -25.68 65.71 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.311 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.29 -37.75 88.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.216 0.531 . . . . 0.0 111.136 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 45.0 mt -60.13 -30.28 69.18 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.015 0.436 . . . . 0.0 111.718 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -59.56 -25.15 64.31 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.211 0.529 . . . . 0.0 110.695 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -81.14 -22.03 39.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.091 0.472 . . . . 0.0 111.328 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -70.01 -49.69 48.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.649 0.737 . . . . 0.0 110.702 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.6 t80 59.78 49.69 7.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.02 0.914 . . . . 0.0 111.031 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -158.21 -70.37 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.867 -0.52 . . . . 0.0 110.855 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.19 -37.18 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.129 0.49 . . . . 0.0 110.912 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.34 -33.74 44.13 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -65.28 -50.86 64.13 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 121.495 -0.753 . . . . 0.0 110.753 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.753 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.2 t90 -65.84 -44.03 86.75 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.854 0.835 . . . . 0.0 109.094 177.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.65 -35.73 81.5 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.25 -28.1 12.83 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -82.6 -6.04 59.13 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.432 -0.792 . . . . 0.0 112.155 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.753 HG23 ' O ' ' B' ' 678' ' ' TRP . 3.3 pt -60.88 -36.74 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.782 -0.574 . . . . 0.0 111.038 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.39 -47.08 69.82 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.075 0.464 . . . . 0.0 110.291 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -68.99 -34.0 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.4 OUTLIER -60.56 -27.62 67.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.38 179.606 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.797 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -60.75 -45.53 97.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.256 0.55 . . . . 0.0 109.537 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 71.6 mt -62.63 -40.87 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' B' ' 685' ' ' PHE . 32.6 mt -58.61 -37.53 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.47 ' O ' HD12 ' B' ' 692' ' ' LEU . 62.8 t -57.77 -43.35 83.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.63 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.71 -26.71 47.4 Favored Glycine 0 CA--C 1.544 1.845 0 O-C-N 121.579 -0.701 . . . . 0.0 111.926 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 18.6 m -60.52 -45.82 92.41 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.47 HD12 ' O ' ' B' ' 689' ' ' VAL . 0.0 OUTLIER -59.62 -32.61 70.58 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 119.674 1.124 . . . . 0.0 111.586 -177.565 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.624 HG22 HG13 ' A' ' 693' ' ' ILE . 0.9 OUTLIER -57.42 -44.98 85.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.579 -0.701 . . . . 0.0 109.628 -178.187 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.09 67.66 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.422 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.8 OUTLIER -60.17 -37.4 80.04 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.018 0.913 . . . . 0.0 110.424 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.5 ' N ' ' HD2' ' B' ' 696' ' ' ARG . 8.4 mpt_? -54.85 -28.48 50.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.077 0.951 . . . . 0.0 113.259 -178.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -36.4 62.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 O-C-N 120.953 -1.092 . . . . 0.0 109.204 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.422 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.25 -30.22 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 121.499 -0.751 . . . . 0.0 110.413 177.379 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 6.6 m-85 -56.29 -31.09 63.33 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 121.861 -0.524 . . . . 0.0 109.861 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.67 77.23 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -42.15 89.63 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.3 tp -58.64 -38.76 78.8 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.423 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -62.92 -35.17 79.21 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.375 0.607 . . . . 0.0 110.414 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -42.32 95.0 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 122.191 0.996 . . . . 0.0 108.965 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.476 HG22 HD13 ' B' ' 748' ' ' LEU . 72.0 t -66.77 -45.17 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 122.192 0.996 . . . . 0.0 108.783 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.458 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.4 m-80 -62.86 -36.43 83.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.419 ' CZ ' ' HG2' ' C' ' 707' ' ' ARG . 23.2 ttm180 -69.0 -50.13 51.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.741 0.781 . . . . 0.0 111.151 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' C' ' 713' ' ' SER . 1.0 OUTLIER -77.95 -44.67 28.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.148 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -59.75 -45.69 91.43 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.597 ' O ' HD12 ' B' ' 715' ' ' LEU . 3.8 pt20 -105.08 -24.11 12.83 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 140.41 164.96 10.11 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -98.5 -65.49 0.96 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.899 -0.765 . . . . 0.0 111.511 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 38.6 p -72.56 159.47 85.28 Favored Pre-proline 0 CA--C 1.532 0.282 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.299 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.593 ' HB3' HD23 ' A' ' 748' ' ' LEU . 38.5 Cg_exo -34.59 125.02 0.19 Allowed 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.269 1.979 . . . . 0.0 113.352 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.597 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.2 tt -87.5 -20.4 26.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.42 ' C ' ' O ' ' B' ' 715' ' ' LEU . 27.2 t . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 122.131 0.967 . . . . 0.0 113.175 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.16 0.981 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -57.93 -26.33 62.1 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.401 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.4 -8.67 0.36 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.683 ' NE ' HD12 ' A' ' 774' ' ' LEU . 4.8 ptt-85 -78.18 -26.65 47.73 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.296 -0.877 . . . . 0.0 111.453 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -58.14 -45.89 86.6 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.97 -0.456 . . . . 0.0 110.095 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.97 -34.76 69.22 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.245 0.545 . . . . 0.0 109.991 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -56.79 -33.7 66.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.357 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.447 HG12 HG22 ' A' ' 778' ' ' VAL . 0.8 OUTLIER -55.63 -17.95 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.37 177.041 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.461 ' HG3' HD21 ' A' ' 785' ' ' LEU . 15.5 ttm180 -58.81 -25.81 63.52 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.507 ' C ' HD12 ' B' ' 748' ' ' LEU . 4.4 pp -55.43 -23.29 24.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.009 0.433 . . . . 0.0 110.593 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 749' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 746' ' ' ILE . 74.7 t -55.41 -53.93 30.62 Favored 'Isoleucine or valine' 0 C--N 1.348 0.537 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 750' ' ' ASN . . . . . 0.451 ' OD1' HD22 ' A' ' 785' ' ' LEU . 8.7 m120 -72.22 -20.11 61.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.355 176.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.45 -20.52 37.91 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 16.3 m -59.04 -41.83 88.8 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 121.871 -0.782 . . . . 0.0 109.804 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -65.78 -50.5 64.48 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.552 0.692 . . . . 0.0 110.09 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.41 -35.4 79.1 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.188 0.518 . . . . 0.0 111.641 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 755' ' ' LEU . . . . . 0.426 HD21 HE22 ' C' ' 710' ' ' GLN . 7.1 tt -59.6 -45.3 92.32 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.909 -0.495 . . . . 0.0 110.857 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 60.0 mt -63.61 -36.56 76.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.808 0.813 . . . . 0.0 108.857 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -30.28 69.13 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.584 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 95.6 m-20 -55.34 -49.4 72.33 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.715 0.769 . . . . 0.0 109.817 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -70.53 -44.69 67.01 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.0 -29.68 70.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -82.05 -45.47 15.23 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -42.68 65.13 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.683 0.754 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.466 HD23 HD11 ' B' ' 771' ' ' LEU . 1.3 tp -60.83 -53.84 52.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.488 -178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.4 p -97.89 -49.48 4.78 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.427 0.632 . . . . 0.0 112.112 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.0 tt 64.9 104.86 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.995 0.902 . . . . 0.0 111.711 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.41 -76.06 0.06 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.84 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 13.3 m -112.78 172.14 7.11 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.429 -0.794 . . . . 0.0 112.071 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -37.54 30.17 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.116 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -53.08 -38.99 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.275 1.036 . . . . 0.0 109.027 178.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 18.7 tpt85 -61.13 -29.76 69.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.007 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.466 HD11 HD23 ' B' ' 763' ' ' LEU . 10.4 tt -59.75 -33.08 71.2 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.854 -0.529 . . . . 0.0 110.537 -178.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -56.66 -32.89 65.82 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -47.67 85.32 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.669 HD12 ' HE ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.723 0.773 . . . . 0.0 110.142 179.657 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.587 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.9 OUTLIER -62.68 -43.07 99.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.085 0.469 . . . . 0.0 111.046 -178.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 65.2 mt -74.01 -41.15 62.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 1.9 pp -70.26 -37.22 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 121.765 -0.585 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.537 HG23 ' O ' ' B' ' 774' ' ' LEU . 40.7 t -61.25 -46.08 97.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.503 -0.748 . . . . 0.0 109.786 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.833 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.0 t -63.77 -41.99 97.87 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 121.766 -0.583 . . . . 0.0 112.085 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -31.86 72.12 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.84 -0.537 . . . . 0.0 111.756 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.73 -36.47 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 122.03 -0.419 . . . . 0.0 110.754 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.833 HG22 ' O ' ' B' ' 779' ' ' THR . 8.9 m -54.06 -38.26 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.572 -0.705 . . . . 0.0 109.908 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -61.22 -41.86 97.6 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.561 0.696 . . . . 0.0 110.425 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.14 -44.06 80.78 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.708 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.723 HD23 ' OD1' ' C' ' 750' ' ' ASN . 27.9 tp -82.88 -13.96 55.15 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.293 0.568 . . . . 0.0 111.351 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.99 -42.41 60.66 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.98 133.19 41.98 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.607 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.633 HD13 HD12 ' B' ' 663' ' ' LEU . 4.3 pp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.43 0.633 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.515 HD22 ' N ' ' C' ' 661' ' ' LEU . 3.3 mm? -113.13 152.6 29.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.344 0.592 . . . . 0.0 109.581 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -167.61 158.11 10.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.319 0.58 . . . . 0.0 109.719 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.663 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -53.18 -53.62 47.88 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 122.135 0.969 . . . . 0.0 109.62 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.581 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -66.76 -18.53 65.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.062 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -81.12 -48.44 12.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.062 0.458 . . . . 0.0 110.495 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.451 ' CZ2' HD12 ' C' ' 661' ' ' LEU . 74.6 m95 -56.6 -46.42 80.88 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.28 0.562 . . . . 0.0 110.338 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.11 -25.67 67.11 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.325 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -35.64 81.54 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 122.077 -0.389 . . . . 0.0 111.463 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.5 -35.92 77.09 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.224 0.535 . . . . 0.0 111.424 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -59.91 -26.74 66.16 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.129 0.49 . . . . 0.0 110.826 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -74.09 -34.38 63.96 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.233 0.54 . . . . 0.0 110.975 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -53.83 -43.64 69.59 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.487 0.66 . . . . 0.0 110.552 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 55.89 41.34 30.12 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.404 0.621 . . . . 0.0 111.165 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -156.67 -72.63 0.1 Allowed 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.724 -0.61 . . . . 0.0 112.18 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.773 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -68.19 -37.6 78.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-O 121.508 0.67 . . . . 0.0 111.684 -178.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.18 -33.65 41.59 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.987 -0.446 . . . . 0.0 112.163 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -56.97 -49.52 75.46 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.592 0.711 . . . . 0.0 110.205 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.678 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.22 -40.79 94.59 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.193 0.52 . . . . 0.0 109.788 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' C' ' 675' ' ' ILE . 13.7 mt -66.07 -38.25 87.82 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -96.02 -18.48 20.19 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.42 -16.06 31.77 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.644 -0.66 . . . . 0.0 111.809 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.678 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.3 pt -62.93 -37.02 78.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.785 -0.572 . . . . 0.0 111.439 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -53.79 -47.38 70.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.611 0.719 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.459 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.92 -36.52 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.74 -32.09 70.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.376 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 1.036 HG21 HD12 ' A' ' 686' ' ' ILE . 9.4 mm -61.16 -47.78 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.168 0.509 . . . . 0.0 109.856 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.4 mt -62.48 -39.86 85.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.206 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.5 mt -58.86 -36.83 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.404 HG23 ' O ' ' C' ' 685' ' ' PHE . 75.8 t -53.98 -40.05 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.8 -41.15 90.66 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.2 m -64.44 -37.8 88.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.656 0.741 . . . . 0.0 109.488 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -59.52 -43.54 93.38 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.262 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.422 ' HB ' HG12 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -68.12 -41.9 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 122.114 -0.366 . . . . 0.0 110.975 -177.514 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.72 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -26.65 65.15 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.626 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.5 tt -67.47 -40.33 85.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.882 0.849 . . . . 0.0 110.376 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -55.65 -28.98 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.72 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -59.31 -35.63 59.23 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.501 -0.75 . . . . 0.0 111.416 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.626 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.9 p -54.1 -29.82 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -55.9 -31.32 62.75 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.793 -0.567 . . . . 0.0 110.303 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.45 81.28 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.08 -41.89 81.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.91 -37.34 79.16 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.568 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 73.5 m -62.64 -39.31 93.44 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.989 0.423 . . . . 0.0 110.765 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -40.91 96.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.868 0.842 . . . . 0.0 108.857 178.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.467 HG22 HD21 ' C' ' 748' ' ' LEU . 98.1 t -62.04 -44.69 99.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -62.23 -35.64 79.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.593 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.419 ' HG2' ' CZ ' ' B' ' 707' ' ' ARG . 2.5 tmm_? -60.07 -50.92 71.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.907 0.86 . . . . 0.0 111.078 -177.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.492 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -77.72 -44.3 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.813 0.816 . . . . 0.0 111.167 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -72.97 -34.71 66.65 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.405 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 710' ' ' GLN . . . . . 0.426 HE22 HD21 ' B' ' 755' ' ' LEU . 8.3 tt0 -102.82 -20.89 14.14 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 115.58 -177.27 17.07 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -128.25 -50.96 1.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.471 ' HA ' HG21 ' B' ' 708' ' ' VAL . 31.6 p -106.78 159.48 29.74 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.356 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -34.06 94.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 122.424 2.082 . . . . 0.0 112.869 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.412 HD23 ' OD2' ' B' ' 758' ' ' ASP . 18.8 tp -81.03 -1.88 45.76 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.958 0.885 . . . . 0.0 113.315 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.797 0.808 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 tpt85 -59.03 -30.5 68.07 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.254 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -56.43 -13.38 2.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.669 ' HE ' HD12 ' B' ' 774' ' ' LEU . 16.8 mtm-85 -75.57 -44.84 41.12 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.565 -0.709 . . . . 0.0 111.468 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.35 -44.36 88.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.188 0.518 . . . . 0.0 109.991 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -36.04 71.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.041 0.448 . . . . 0.0 110.327 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -57.56 -42.86 83.87 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.908 -0.495 . . . . 0.0 110.274 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.546 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.5 mp -53.96 -19.74 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.635 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 747' ' ' ARG . . . . . 0.711 ' HA ' HD22 ' B' ' 785' ' ' LEU . 65.5 mtt180 -59.44 -34.26 72.29 Favored 'General case' 0 C--N 1.343 0.285 0 O-C-N 121.071 -1.018 . . . . 0.0 109.26 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.545 ' O ' HD23 ' C' ' 748' ' ' LEU . 9.6 tt -57.35 -17.64 13.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 749' ' ' VAL . . . . . 0.433 HG12 ' OD1' ' C' ' 750' ' ' ASN . 0.3 OUTLIER -55.84 -53.35 38.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -179.506 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.723 ' OD1' HD23 ' B' ' 785' ' ' LEU . 8.9 m120 -71.89 -18.68 62.03 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.558 0.694 . . . . 0.0 109.568 175.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.27 -20.58 36.8 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.9 p -58.31 -37.9 75.99 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -69.22 -50.34 48.22 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.653 0.74 . . . . 0.0 109.232 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.09 -34.64 72.22 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.935 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.465 ' C ' HD23 ' C' ' 755' ' ' LEU . 7.0 tt -58.71 -45.47 89.48 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.908 -0.495 . . . . 0.0 111.067 -177.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 74.2 mt -68.26 -41.78 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.771 0.796 . . . . 0.0 108.981 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -67.1 -30.68 70.77 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.74 -45.67 92.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.224 -0.923 . . . . 0.0 108.608 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -42.27 72.69 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.595 0.712 . . . . 0.0 110.975 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -42.64 76.63 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 761' ' ' ARG . . . . . 0.442 ' O ' HD12 ' C' ' 765' ' ' LEU . 19.9 mtm180 -74.57 -49.44 21.78 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.062 0.458 . . . . 0.0 111.841 -178.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.6 t -59.77 -45.85 91.0 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.478 -0.764 . . . . 0.0 110.18 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.438 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.2 tt -68.84 -54.15 17.34 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.574 ' CB ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -99.19 -49.63 4.42 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.826 0.822 . . . . 0.0 112.785 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 765' ' ' LEU . . . . . 0.442 HD12 ' O ' ' C' ' 761' ' ' ARG . 0.4 OUTLIER 77.41 -179.53 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.474 0.709 . . . . 0.0 109.368 -177.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.99 138.09 6.84 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.476 0.655 . . . . 0.0 111.156 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 m 57.94 165.07 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.5 0.667 . . . . 0.0 111.065 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.32 0.65 43.38 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.402 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -81.62 -44.76 16.76 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 -64.15 -28.36 69.71 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.561 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.574 HD12 ' CB ' ' C' ' 764' ' ' SER . 0.3 OUTLIER -58.18 -30.1 66.16 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.35 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -56.61 -32.88 65.72 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -65.27 -47.32 77.12 Favored 'General case' 0 C--N 1.352 0.693 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.561 HD13 HD12 ' C' ' 777' ' ' ILE . 4.5 mm? -59.2 -37.6 77.86 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.603 0.716 . . . . 0.0 110.319 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.55 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.3 mp -57.68 -36.35 71.82 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.652 0.739 . . . . 0.0 109.909 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.89 -40.42 60.93 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.507 -0.746 . . . . 0.0 110.361 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.603 HG21 HH11 ' A' ' 742' ' ' ARG . 41.9 mt -62.88 -37.37 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 O-C-N 122.252 -0.28 . . . . 0.0 111.618 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.55 HG22 ' O ' ' C' ' 775' ' ' LEU . 29.6 m -55.44 -39.59 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.281 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.7 m -63.47 -40.67 97.72 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-O 121.971 0.891 . . . . 0.0 109.584 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.81 -38.42 86.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.657 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.797 HG21 ' HB ' ' A' ' 746' ' ' ILE . 63.9 mt -60.56 -42.22 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.8 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.402 ' HA ' ' CG ' ' A' ' 747' ' ' ARG . 48.6 t -53.7 -38.33 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.631 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.34 -45.12 89.2 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.93 -0.481 . . . . 0.0 111.358 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.64 -45.1 65.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.752 HD23 ' HB3' ' A' ' 747' ' ' ARG . 11.8 tp -87.82 -13.98 40.76 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 121.011 -1.056 . . . . 0.0 110.599 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.89 -25.48 16.27 Favored Glycine 0 CA--C 1.538 1.485 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.7 136.31 52.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.859 -1.067 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.717 ' N ' HD23 ' C' ' 663' ' ' LEU . 3.5 tp . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 47.3 mt 58.13 104.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.772 0.796 . . . . 0.0 110.834 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -174.65 -171.51 0.57 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.568 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.2 tt -52.69 -41.22 63.67 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.564 -0.71 . . . . 0.0 110.635 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.5 -32.24 66.02 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -77.48 -44.93 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.435 0.636 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -70.46 -44.64 67.33 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.3 0.571 . . . . 0.0 110.847 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.79 65.82 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.524 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 46.3 t -66.92 -34.94 78.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.208 0.528 . . . . 0.0 111.271 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -35.22 74.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.376 0.608 . . . . 0.0 111.079 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.88 -22.79 62.82 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.203 0.525 . . . . 0.0 111.242 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -79.86 -20.81 45.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.247 0.546 . . . . 0.0 111.264 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -71.55 -49.79 37.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.598 0.713 . . . . 0.0 110.456 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 39.3 t80 62.15 39.38 12.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.832 0.825 . . . . 0.0 111.118 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -152.77 -68.3 0.16 Allowed 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.83 -0.544 . . . . 0.0 110.94 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.07 -36.95 77.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.096 -0.377 . . . . 0.0 111.213 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -51.81 -34.35 39.71 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.84 -50.1 67.99 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 121.685 -0.634 . . . . 0.0 110.32 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.4 t90 -65.69 -44.01 87.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.79 0.805 . . . . 0.0 109.695 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -35.72 81.33 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -96.13 -43.72 7.62 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -68.21 -6.66 24.72 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.693 -0.629 . . . . 0.0 112.552 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.764 HD12 ' N ' ' A' ' 683' ' ' ARG . 1.7 pp -60.63 -36.43 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 121.626 -0.671 . . . . 0.0 110.403 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.764 ' N ' HD12 ' A' ' 682' ' ' ILE . 9.9 ttt-85 -57.06 -47.27 81.38 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.046 0.45 . . . . 0.0 110.606 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -67.74 -34.13 65.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.4 OUTLIER -59.9 -31.33 69.72 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.041 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.872 HG21 HD12 ' B' ' 686' ' ' ILE . 14.5 mm -60.7 -49.31 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.117 0.484 . . . . 0.0 109.824 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.79 -40.39 84.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.99 -36.77 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.86 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 685' ' ' PHE . 86.9 t -54.16 -39.83 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.4 -37.09 91.5 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.4 m -64.87 -38.29 90.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.759 0.79 . . . . 0.0 109.602 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.751 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.1 -40.8 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.339 -179.292 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.81 -23.41 61.15 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.552 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -61.63 -38.28 87.09 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.03 0.919 . . . . 0.0 109.506 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.5 mmt180 -55.92 -28.0 54.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.286 1.034 . . . . 0.0 112.767 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 mm -58.7 -37.44 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 O-C-N 121.077 -1.014 . . . . 0.0 108.339 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.771 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.5 p -67.72 -30.74 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 121.481 -0.762 . . . . 0.0 109.887 176.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.5 m-85 -55.88 -28.68 57.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 110.442 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.04 71.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.8 m -64.49 -36.0 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.669 -0.644 . . . . 0.0 110.043 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.2 tp -57.7 -40.05 78.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 122.028 -0.42 . . . . 0.0 111.016 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 703' ' ' SER . . . . . 0.548 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 1.6 m -62.78 -37.41 86.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.534 0.683 . . . . 0.0 110.499 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -42.0 96.7 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 122.089 0.947 . . . . 0.0 108.702 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 748' ' ' LEU . 73.4 t -65.18 -43.74 95.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.981 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 706' ' ' ASN . . . . . 0.411 ' CG ' HE22 ' A' ' 710' ' ' GLN . 1.6 m-80 -62.22 -42.89 99.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.356 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.54 HH21 HG23 ' A' ' 708' ' ' VAL . 7.6 tmm_? -60.99 -43.79 98.36 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.411 0.624 . . . . 0.0 110.697 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.54 HG23 HH21 ' A' ' 707' ' ' ARG . 0.9 OUTLIER -74.4 -43.47 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.178 0.989 . . . . 0.0 109.179 178.795 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.13 -15.04 61.49 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 710' ' ' GLN . . . . . 0.411 HE22 ' CG ' ' A' ' 706' ' ' ASN . 0.2 OUTLIER -101.23 -22.3 14.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.62 1.554 . . . . 0.0 113.268 -177.552 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 711' ' ' GLY . . . . . 0.587 ' HA3' HD22 ' A' ' 715' ' ' LEU . . . 130.98 14.07 1.89 Allowed Glycine 0 CA--C 1.537 1.422 0 O-C-N 121.376 -0.828 . . . . 0.0 113.544 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.468 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 61.33 -127.62 0.83 Allowed 'General case' 0 CA--C 1.571 1.775 0 O-C-N 121.556 -0.967 . . . . 0.0 110.466 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.468 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 89.3 p -62.08 159.9 34.41 Favored Pre-proline 0 C--N 1.353 0.72 0 O-C-N 120.669 -1.27 . . . . 0.0 110.782 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -35.12 110.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.301 2.0 . . . . 0.0 112.593 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.639 HD23 ' OD2' ' C' ' 758' ' ' ASP . 0.0 OUTLIER -109.04 -20.73 12.92 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.834 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 122.56 1.172 . . . . 0.0 111.798 -179.622 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 121.683 0.754 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -58.02 -26.47 62.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.595 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -9.23 0.42 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 8.1 mtm-85 -62.89 -46.53 87.38 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.369 -0.832 . . . . 0.0 111.142 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.543 ' O ' HG23 ' C' ' 781' ' ' ILE . 44.4 p-10 -65.84 -38.68 89.51 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.283 0.563 . . . . 0.0 111.871 -178.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -71.44 -38.01 71.39 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 121.163 -0.96 . . . . 0.0 109.845 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 20.6 p -66.25 -45.96 78.77 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.948 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.83 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.4 mp -63.12 -46.74 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-O 117.89 -1.053 . . . . 0.0 111.262 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.653 ' HE ' HD23 ' C' ' 785' ' ' LEU 0.321 0.1 OUTLIER -69.93 -0.06 6.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 115.822 -2.351 . . . . 0.0 111.614 -177.624 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.795 ' O ' HD13 ' A' ' 748' ' ' LEU . 2.8 tm? -57.23 -15.65 6.41 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 169.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 746' ' ' ILE 0.314 2.0 t -53.4 -54.64 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 175.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -73.25 -27.21 61.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.48 173.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.478 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.8 -19.3 28.35 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.697 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 52.2 p -57.27 -37.23 72.07 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.91 -49.45 76.15 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.29 72.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.646 178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.15 -43.24 92.04 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.706 -0.621 . . . . 0.0 111.899 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 756' ' ' ILE . . . . . 0.424 HG22 HD12 ' A' ' 760' ' ' LEU . 49.2 mt -61.36 -33.66 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -69.43 -30.63 68.6 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.947 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 5.7 m-20 -56.07 -48.44 76.07 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.985 0.898 . . . . 0.0 108.955 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.39 -44.3 68.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.509 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.424 HD12 HG22 ' A' ' 756' ' ' ILE . 30.1 mt -67.37 -35.0 78.46 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -177.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 32.4 mtm180 -79.73 -19.51 48.63 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 68.6 p -77.36 -46.39 22.99 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.34 -0.85 . . . . 0.0 111.27 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 mp -68.89 -53.97 18.16 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 53.8 p -98.45 -48.95 4.83 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.221 -0.924 . . . . 0.0 111.939 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.8 tp 89.22 -82.97 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.675 1.19 . . . . 0.0 110.263 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -106.05 -65.42 1.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.572 -0.705 . . . . 0.0 110.756 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.6 m -103.05 144.44 31.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.117 0.484 . . . . 0.0 110.596 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -62.41 -26.74 68.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.085 0.469 . . . . 0.0 110.373 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -52.98 -39.06 62.73 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.599 0.714 . . . . 0.0 109.885 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.4 tpt85 -63.35 -30.62 71.72 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.662 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.42 -38.24 83.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.165 0.507 . . . . 0.0 110.481 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 58.0 ttp180 -59.03 -42.16 89.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.648 0.737 . . . . 0.0 109.207 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -69.05 -43.42 74.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.821 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -62.16 -37.7 86.19 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 121.53 0.681 . . . . 0.0 111.46 -179.317 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.39 -36.92 83.83 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 121.65 -0.656 . . . . 0.0 111.062 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.4 mt -74.15 -44.43 53.63 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 774' ' ' LEU . 2.3 pp -59.96 -37.14 71.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 121.98 -0.45 . . . . 0.0 111.419 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.753 ' O ' HG22 ' A' ' 781' ' ' ILE . 26.7 m -65.92 -43.17 93.0 Favored 'Isoleucine or valine' 0 C--N 1.346 0.42 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.757 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 782' ' ' VAL . 47.2 p -63.81 -46.6 84.39 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.433 -0.792 . . . . 0.0 111.508 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.11 -30.32 71.5 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.774 HG21 ' CG2' ' B' ' 746' ' ' ILE . 0.2 OUTLIER -53.35 -35.24 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 O-C-N 121.847 -0.533 . . . . 0.0 110.563 -178.01 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 779' ' ' THR . 17.1 m -53.76 -38.33 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -62.69 -43.22 99.37 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.761 0.791 . . . . 0.0 110.216 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 22.5 tp -68.03 -40.98 82.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.359 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 tp -86.03 -11.07 53.85 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.988 0.423 . . . . 0.0 111.826 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -72.25 1.41 34.39 Favored Glycine 0 CA--C 1.54 1.65 0 O-C-N 121.75 -0.593 . . . . 0.0 112.488 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -116.12 151.94 34.63 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.732 -0.863 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.524 179.753 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 61.91 112.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.227 0.536 . . . . 0.0 109.865 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 170.99 -176.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.669 HD13 HD22 ' C' ' 660' ' ' LEU . 5.7 tp -54.33 -48.42 71.39 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 122.171 0.986 . . . . 0.0 109.663 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -65.4 -32.44 74.07 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.541 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -78.73 -44.18 24.07 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.151 0.5 . . . . 0.0 110.726 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.73 -44.08 62.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.299 0.571 . . . . 0.0 111.319 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.57 -30.28 71.2 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.999 0.428 . . . . 0.0 111.534 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 24.5 p -63.35 -25.79 68.46 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.068 0.461 . . . . 0.0 111.699 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.05 -38.67 86.99 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.304 0.574 . . . . 0.0 110.963 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -61.71 -12.98 19.05 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.978 0.418 . . . . 0.0 111.537 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.64 -32.28 20.65 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.241 0.543 . . . . 0.0 111.252 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.57 -52.19 64.4 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.48 0.657 . . . . 0.0 110.507 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 33.1 t80 58.19 27.76 15.56 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.409 0.623 . . . . 0.0 112.184 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -141.07 -71.17 0.36 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.436 0.636 . . . . 0.0 110.455 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.69 HD11 HD23 ' B' ' 679' ' ' LEU . 0.1 OUTLIER -68.18 -36.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.4 m -51.28 -33.49 28.86 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.039 -0.413 . . . . 0.0 111.539 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.94 -50.31 73.01 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.704 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.4 t90 -66.16 -41.86 89.77 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.933 0.873 . . . . 0.0 109.422 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.69 HD23 HD11 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -58.07 -35.52 71.49 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -177.723 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -109.46 -31.19 7.61 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -68.22 -6.76 25.34 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.451 -0.781 . . . . 0.0 112.91 -177.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.704 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.41 -36.29 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.6 -0.688 . . . . 0.0 110.839 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -53.32 -47.6 69.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.615 0.245 . . . . 0.0 111.028 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -71.54 -35.64 57.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.7 -31.07 69.25 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.064 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.872 HD12 HG21 ' A' ' 686' ' ' ILE . 15.0 mm -60.89 -47.28 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.774 -0.579 . . . . 0.0 109.918 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.71 -41.67 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.72 -37.94 73.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -60.18 -40.15 82.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 690' ' ' GLY . . . . . 0.545 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -61.41 -27.1 67.24 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 19.9 m -60.78 -45.38 94.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.607 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -33.13 71.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -176.479 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.859 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.1 OUTLIER -57.86 -43.93 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.932 0.787 . . . . 0.0 109.739 -178.7 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.05 -32.68 83.11 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.55 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.8 tt -60.46 -37.48 81.12 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 122.067 0.937 . . . . 0.0 110.769 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.751 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.9 mmt180 -55.87 -28.49 56.8 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.754 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.59 -36.39 59.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 O-C-N 120.978 -1.076 . . . . 0.0 110.419 -176.235 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -56.82 -30.22 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 121.253 -0.905 . . . . 0.0 110.561 178.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -56.53 -30.92 63.61 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.711 -0.618 . . . . 0.0 110.317 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.69 77.75 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -41.82 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.48 -37.74 73.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.077 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.7 m -62.86 -35.46 80.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 110.537 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.77 -43.21 97.07 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 122.406 1.098 . . . . 0.0 108.997 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.521 HG13 HD11 ' B' ' 748' ' ' LEU . 94.7 t -69.39 -45.49 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.201 1.001 . . . . 0.0 109.354 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.475 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 2.2 m120 -62.82 -35.58 80.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.199 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 16.1 ttm-85 -66.41 -50.25 64.06 Favored 'General case' 0 N--CA 1.44 -0.934 0 O-C-N 121.301 -0.874 . . . . 0.0 110.688 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.9 OUTLIER -78.72 -45.07 25.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -179.143 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -61.38 -45.23 95.24 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.4 pt20 -104.54 -22.89 13.2 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.66 167.64 11.03 Favored Glycine 0 CA--C 1.534 1.231 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.82 -83.6 0.55 Allowed 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.795 -0.827 . . . . 0.0 112.65 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.8 m -62.87 159.44 45.47 Favored Pre-proline 0 N--CA 1.463 0.184 0 O-C-N 121.331 -0.855 . . . . 0.0 110.177 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.582 ' HG3' HD23 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -30.08 108.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.529 2.153 . . . . 0.0 113.372 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.44 ' O ' ' C ' ' B' ' 716' ' ' SER . 4.8 tt -70.92 -20.38 62.49 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.44 ' C ' ' O ' ' B' ' 715' ' ' LEU . 12.4 t . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 122.402 1.096 . . . . 0.0 112.91 -178.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 11.9 mp0 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 mtp85 -72.24 -28.51 63.2 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.202 0.525 . . . . 0.0 110.975 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.9 -5.19 1.92 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.494 ' NE ' HD11 ' A' ' 774' ' ' LEU . 0.1 OUTLIER -54.87 -32.71 61.1 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.701 -1.249 . . . . 0.0 109.423 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -58.59 -34.61 71.29 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 122.08 0.943 . . . . 0.0 108.553 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 744' ' ' ARG . . . . . 0.48 ' HG2' HH21 ' B' ' 744' ' ' ARG . 0.0 OUTLIER -63.54 -46.96 83.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 122.141 0.972 . . . . 0.0 109.135 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 13.8 t -62.34 -47.18 85.37 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.783 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.774 ' CG2' HG21 ' A' ' 781' ' ' ILE . 1.4 mp -52.63 -21.4 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 O-C-N 121.24 -0.912 . . . . 0.0 109.655 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -43.54 98.64 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.669 -0.645 . . . . 0.0 110.542 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.521 HD11 HG13 ' B' ' 705' ' ' VAL . 0.9 OUTLIER -55.59 -15.37 2.84 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.668 -0.645 . . . . 0.0 111.964 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.44 -53.76 32.57 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -72.59 -17.77 61.66 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.125 174.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 751' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.0 -20.06 32.74 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.857 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 3.5 m -58.47 -38.45 77.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 118.356 1.078 . . . . 0.0 109.572 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.33 -48.04 58.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.65 0.738 . . . . 0.0 109.731 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.56 81.38 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -45.24 92.87 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.649 -0.657 . . . . 0.0 110.627 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 756' ' ' ILE . . . . . 0.439 HG22 HD12 ' B' ' 760' ' ' LEU . 47.2 mt -62.01 -36.4 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.11 -30.96 69.34 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.952 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.512 ' OD2' HD23 ' C' ' 715' ' ' LEU . 6.9 m-20 -55.94 -48.32 75.96 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.56 -45.32 65.67 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.034 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 760' ' ' LEU . . . . . 0.439 HD12 HG22 ' B' ' 756' ' ' ILE . 19.9 mt -66.91 -31.79 72.61 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -79.98 -49.47 11.79 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.2 m -65.24 -45.23 85.48 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.543 -0.723 . . . . 0.0 111.576 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.586 ' HG ' HD22 ' B' ' 774' ' ' LEU . 1.9 tp -64.66 -53.25 50.48 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.838 -0.539 . . . . 0.0 112.447 -178.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 764' ' ' SER . . . . . 0.411 ' OG ' HD12 ' B' ' 771' ' ' LEU . 3.0 m -97.5 -47.57 5.61 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 1.8 mt 71.63 107.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.8 0.81 . . . . 0.0 110.315 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.89 -78.45 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.881 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -110.11 175.47 5.42 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.612 0.72 . . . . 0.0 111.572 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -84.22 -27.96 27.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.064 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.61 -40.14 82.43 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 122.109 0.957 . . . . 0.0 109.149 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.62 -29.26 67.88 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.892 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.411 HD12 ' OG ' ' B' ' 764' ' ' SER . 8.4 tt -59.16 -32.33 69.79 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.679 -0.638 . . . . 0.0 109.986 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -56.78 -32.51 65.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.03 -41.26 99.47 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.586 HD22 ' HG ' ' B' ' 763' ' ' LEU . 2.7 tp -58.86 -38.49 78.9 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-O 121.388 0.613 . . . . 0.0 110.835 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.34 -37.04 74.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.275 0.56 . . . . 0.0 109.997 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.42 -34.85 68.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.056 0.455 . . . . 0.0 110.592 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.3 -39.26 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.089 0.471 . . . . 0.0 109.779 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.76 ' O ' HG22 ' B' ' 781' ' ' ILE . 58.6 t -66.28 -46.63 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.784 -0.572 . . . . 0.0 109.945 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.645 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -64.21 -44.48 91.82 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 122.079 -0.388 . . . . 0.0 112.023 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -31.5 72.04 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 122.052 -0.405 . . . . 0.0 111.739 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.76 HG22 ' O ' ' B' ' 778' ' ' VAL . 0.4 OUTLIER -60.01 -36.6 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 O-C-N 121.727 -0.608 . . . . 0.0 112.07 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.645 HG22 ' O ' ' B' ' 779' ' ' THR . 5.4 m -59.22 -41.78 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 121.655 -0.653 . . . . 0.0 112.083 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -41.85 91.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.273 0.559 . . . . 0.0 111.338 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.68 -44.04 67.84 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.659 HD23 ' CG ' ' C' ' 750' ' ' ASN . 18.9 tp -83.78 -22.87 31.72 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.027 0.441 . . . . 0.0 111.73 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.67 -33.21 62.49 Favored Glycine 0 CA--C 1.533 1.217 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -83.19 146.99 28.3 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.398 0.618 . . . . 0.0 110.581 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.476 179.691 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.669 HD22 HD13 ' B' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 CA-C-O 120.641 0.258 . . . . 0.0 110.784 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 25.7 mt 59.62 110.74 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.519 0.676 . . . . 0.0 110.852 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.6 171.1 10.55 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 121.244 0.545 . . . . 0.0 109.711 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.6 OUTLIER -56.91 -50.48 72.41 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.62 0.724 . . . . 0.0 110.054 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.541 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -75.18 -16.86 60.48 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.908 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -80.96 -49.01 11.5 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.022 0.439 . . . . 0.0 110.881 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -62.71 -46.14 89.52 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.248 0.547 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.23 -23.54 67.47 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -30.55 68.24 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 122.003 -0.436 . . . . 0.0 111.781 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -39.67 94.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -59.47 -13.51 9.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.762 -0.586 . . . . 0.0 111.848 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -81.77 -21.11 37.99 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.277 0.561 . . . . 0.0 110.899 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -62.44 -42.22 99.3 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.648 0.737 . . . . 0.0 110.138 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 61.37 24.76 14.82 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -154.09 -72.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.562 -0.711 . . . . 0.0 112.313 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -37.1 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-O 121.52 0.676 . . . . 0.0 110.257 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.8 m -52.2 -33.7 42.16 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.778 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -56.52 -48.88 76.31 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 121.63 0.729 . . . . 0.0 109.341 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.524 ' O ' HG23 ' C' ' 682' ' ' ILE . 3.8 t90 -58.86 -38.09 77.97 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.874 -0.516 . . . . 0.0 109.8 178.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 9.4 mt -60.72 -41.08 94.6 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -103.27 -39.22 6.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -68.87 -18.56 64.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.759 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.45 -36.57 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.449 -0.782 . . . . 0.0 109.947 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.759 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -53.7 -46.98 70.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.02 -35.23 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.97 -36.77 77.83 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.994 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.811 HG21 HD12 ' A' ' 686' ' ' ILE . 18.5 mm -60.78 -45.53 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.89 -38.43 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.91 -37.99 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.5 -40.01 72.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.29 -37.54 73.87 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.0 m -67.37 -38.64 85.08 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.452 1.12 . . . . 0.0 109.661 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.415 HD23 HG12 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.6 -46.12 89.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.406 -177.595 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.415 HD12 ' N ' ' C' ' 694' ' ' GLY . 1.7 pp -60.29 -43.63 93.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 O-C-N 122.017 -0.427 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.54 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.74 -30.68 73.17 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.61 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -53.77 -37.22 63.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.058 0.932 . . . . 0.0 110.139 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.859 ' HE ' HD11 ' B' ' 693' ' ' ILE . 23.0 mmt180 -55.69 -27.85 52.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.54 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -57.66 -35.41 50.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.079 -1.013 . . . . 0.0 110.831 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.61 HG12 ' O ' ' C' ' 695' ' ' LEU . 14.5 p -54.08 -29.86 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.223 -0.923 . . . . 0.0 109.527 177.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -56.83 -31.69 65.0 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.263 -0.898 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 700' ' ' ALA . . . . . 0.548 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.14 -45.3 93.51 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 45.3 t -65.82 -35.86 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.009 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -64.95 -44.89 87.95 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.231 0.539 . . . . 0.0 110.865 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 36.3 p -64.13 -33.04 74.88 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.15 0.5 . . . . 0.0 110.776 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.75 95.23 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.833 0.825 . . . . 0.0 108.922 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' C' ' 748' ' ' LEU . 0.9 OUTLIER -67.62 -45.81 84.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-O 122.149 0.976 . . . . 0.0 108.618 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.06 -36.48 83.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.224 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -49.21 73.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.208 0.528 . . . . 0.0 111.26 -177.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.556 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -76.73 -42.98 34.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.501 0.667 . . . . 0.0 111.511 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -70.38 -41.35 73.18 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 710' ' ' GLN . . . . . 0.407 ' O ' HD22 ' C' ' 715' ' ' LEU . 3.0 mt-30 -102.23 -22.13 14.23 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.759 0.79 . . . . 0.0 112.973 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.35 160.37 24.21 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -112.98 -47.63 3.03 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.936 -0.743 . . . . 0.0 111.536 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.452 ' HA ' HG21 ' B' ' 708' ' ' VAL . 79.5 p -69.11 144.28 95.14 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 118.616 -0.707 . . . . 0.0 110.306 -179.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -35.23 97.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.553 0 C-N-CA 122.261 1.974 . . . . 0.0 112.394 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.512 HD23 ' OD2' ' B' ' 758' ' ' ASP . 13.6 tp -75.19 5.1 5.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.82 0.819 . . . . 0.0 112.277 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 122.422 1.106 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -61.1 -26.55 67.74 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.61 -1.177 . . . . 0.0 112.084 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.7 -11.59 1.0 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -68.42 -40.89 81.03 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.53 -0.731 . . . . 0.0 111.46 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.33 -36.02 72.78 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 122.031 -0.418 . . . . 0.0 110.501 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -71.34 -46.73 59.84 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.337 0.589 . . . . 0.0 110.017 178.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 3.1 p -59.93 -38.51 82.62 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.469 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.548 ' CG2' HG21 ' B' ' 781' ' ' ILE . 1.0 OUTLIER -57.44 -19.67 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -59.55 -28.11 66.81 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.556 HD11 HG12 ' C' ' 708' ' ' VAL . 15.7 mt -55.65 -20.39 13.8 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.915 178.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 749' ' ' VAL . . . . . 0.496 HG23 ' O ' ' C' ' 746' ' ' ILE . 70.7 t -56.0 -54.89 21.82 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.659 ' CG ' HD23 ' B' ' 785' ' ' LEU . 7.3 m120 -73.29 -21.9 60.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.784 174.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.15 33.32 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.206 -178.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 37.5 m -58.59 -37.73 76.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 117.921 0.861 . . . . 0.0 109.315 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -69.45 -50.44 45.55 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.496 0.665 . . . . 0.0 109.743 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.2 -35.36 80.06 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.521 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.7 tm? -59.82 -45.34 92.67 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 111.158 -178.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 64.4 mt -67.77 -41.77 85.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.86 0.838 . . . . 0.0 109.338 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.14 -30.09 68.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.207 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 758' ' ' ASP . . . . . 0.639 ' OD2' HD23 ' A' ' 715' ' ' LEU . 81.4 m-20 -55.32 -48.87 73.5 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.495 -0.753 . . . . 0.0 109.987 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -70.58 -44.72 66.76 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.876 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 62.3 mt -68.88 -36.08 77.66 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 26.2 mtm180 -72.39 -50.02 29.63 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.965 -0.459 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.5 t -64.87 -44.45 89.65 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 122.159 0.981 . . . . 0.0 110.337 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.1 tt -67.94 -53.17 28.36 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.212 -0.903 . . . . 0.0 113.225 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.437 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.3 m -96.78 -37.47 10.26 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 56.5 mt 62.06 116.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.466 0.651 . . . . 0.0 110.128 -178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 2.0 t80 59.29 -162.96 0.23 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.874 -0.516 . . . . 0.0 109.997 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 p -83.38 91.89 7.43 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.667 0.746 . . . . 0.0 111.671 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 42.42 -165.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.888 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 10.9 t60 75.91 -61.42 0.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -61.31 -30.06 70.26 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.702 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.437 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.0 tt -60.04 -30.8 69.43 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 122.075 -0.391 . . . . 0.0 109.957 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -56.69 -35.15 68.15 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 773' ' ' ASP . . . . . 0.401 ' O ' HG13 ' C' ' 777' ' ' ILE . 3.7 m-20 -67.12 -37.06 83.23 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.684 HD13 ' O ' ' C' ' 774' ' ' LEU . 1.8 tm? -58.06 -38.49 76.41 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.064 0.459 . . . . 0.0 110.21 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.467 ' O ' HG22 ' C' ' 778' ' ' VAL . 9.8 mp -58.98 -37.59 77.16 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 51.1 mt -75.09 -39.99 60.33 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 121.675 -0.641 . . . . 0.0 111.339 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.474 HG22 HG13 ' C' ' 781' ' ' ILE . 29.1 mt -62.49 -37.49 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.563 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.467 HG22 ' O ' ' C' ' 775' ' ' LEU . 7.8 m -55.16 -39.83 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.202 0.91 . . . . 0.0 110.015 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.445 ' O ' HG22 ' C' ' 782' ' ' VAL . 5.8 m -63.41 -39.8 95.47 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 121.871 0.843 . . . . 0.0 109.741 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.43 -37.55 83.2 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.536 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.83 HG21 ' HB ' ' A' ' 746' ' ' ILE . 89.4 mt -61.69 -47.69 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.41 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.446 ' HA ' ' HD2' ' A' ' 747' ' ' ARG . 20.7 m -54.13 -37.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 119.23 -0.988 . . . . 0.0 110.677 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -61.75 -41.28 97.48 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.318 0.58 . . . . 0.0 111.694 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.76 -44.69 76.9 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.653 HD23 ' HE ' ' A' ' 747' ' ' ARG . 0.5 OUTLIER -80.01 -27.45 39.57 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.093 -1.004 . . . . 0.0 110.713 -178.185 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 786' ' ' GLY . . . . . 0.418 ' HA2' ' CZ ' ' A' ' 747' ' ' ARG . . . -52.29 -33.8 39.63 Favored Glycine 0 CA--C 1.534 1.223 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.13 143.67 50.81 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 122.186 -0.597 . . . . 0.0 110.178 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.544 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 121.669 0.747 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mt 61.92 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.996 0.903 . . . . 0.0 111.82 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 174.81 163.59 0.23 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.495 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.416 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.8 OUTLIER -46.36 -41.48 13.52 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.64 0.733 . . . . 0.0 110.148 178.859 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -33.87 76.97 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.774 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -74.8 -44.77 47.7 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.417 0.627 . . . . 0.0 109.782 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -63.12 -46.39 87.53 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.436 0.636 . . . . 0.0 110.364 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.19 61.82 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.493 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 2.7 m -65.38 -33.25 75.52 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.604 HD23 HG23 ' A' ' 676' ' ' THR . 19.6 tp -65.35 -23.75 67.07 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.808 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -60.02 -29.47 68.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.933 -0.48 . . . . 0.0 111.586 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.8 -14.48 62.78 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 19.4 m95 -68.44 -49.63 58.5 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.439 0.638 . . . . 0.0 110.108 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 13.3 t80 65.83 2.77 2.28 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -126.04 -66.78 0.91 Allowed 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.279 -0.888 . . . . 0.0 111.942 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.42 -36.92 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 121.368 0.604 . . . . 0.0 111.025 -179.049 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.604 HG23 HD23 ' A' ' 669' ' ' LEU . 2.9 m -52.07 -33.38 38.96 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.471 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -56.4 -49.57 74.1 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.507 0.67 . . . . 0.0 109.777 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.77 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.8 t90 -65.36 -43.9 89.34 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 121.084 0.469 . . . . 0.0 109.809 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.485 HD12 HD21 ' A' ' 669' ' ' LEU . 2.6 mt -61.92 -34.85 76.83 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.9 t90 -103.52 -15.03 15.97 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -94.5 -9.19 36.15 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.77 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -62.38 -35.95 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 O-C-N 121.371 -0.831 . . . . 0.0 110.818 179.054 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -47.42 68.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.783 0.325 . . . . 0.0 111.266 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -70.9 -35.34 59.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.496 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -60.61 -29.0 68.94 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.584 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.868 HD12 HG21 ' C' ' 686' ' ' ILE . 15.9 mm -60.52 -51.06 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.739 -0.601 . . . . 0.0 110.123 -179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.62 -41.03 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.93 -37.49 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.31 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 685' ' ' PHE . 61.6 t -54.86 -43.29 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -52.68 -40.08 55.44 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.9 m -65.49 -38.67 90.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.848 0.832 . . . . 0.0 109.615 177.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.73 -43.05 94.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.304 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.512 HD11 HH11 ' B' ' 696' ' ' ARG . 0.8 OUTLIER -65.36 -42.7 94.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-O 121.126 0.489 . . . . 0.0 109.951 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.85 -24.92 65.17 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 178.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -55.92 -38.61 70.51 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.021 0.915 . . . . 0.0 109.185 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.0 mmt180 -55.72 -28.15 54.26 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.827 0.851 . . . . 0.0 111.775 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.99 -39.09 77.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.801 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.74 -30.76 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.662 -0.649 . . . . 0.0 109.963 176.313 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.9 m-85 -55.76 -29.34 59.45 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 122.003 -0.436 . . . . 0.0 110.692 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.56 -37.24 72.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -60.71 -35.98 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 O-C-N 121.701 -0.624 . . . . 0.0 109.503 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.92 -44.62 91.35 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.81 -0.556 . . . . 0.0 109.88 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -34.66 77.78 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 122.117 0.96 . . . . 0.0 108.819 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.573 HD13 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -60.63 -44.29 96.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 122.308 1.052 . . . . 0.0 108.272 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.669 HG22 HD12 ' A' ' 748' ' ' LEU . 54.2 t -66.81 -41.81 88.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.889 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -62.34 -36.91 83.68 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.036 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.573 HH22 HD13 ' A' ' 704' ' ' LEU . 36.0 ttm105 -57.65 -49.49 76.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 120.833 -1.167 . . . . 0.0 110.481 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.412 HG21 ' HD2' ' B' ' 714' ' ' PRO . 1.0 OUTLIER -76.97 -45.21 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.147 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -74.71 -18.33 60.53 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -101.26 -21.01 15.01 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 120.15 13.64 5.83 Favored Glycine 0 CA--C 1.542 1.78 0 O-C-N 121.604 -0.685 . . . . 0.0 113.115 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 59.29 -83.77 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 O-C-N 121.934 -0.745 . . . . 0.0 112.069 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 92.2 p -102.77 159.99 27.62 Favored Pre-proline 0 C--N 1.347 0.462 0 O-C-N 121.2 -0.938 . . . . 0.0 109.721 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -41.75 106.57 0.07 OUTLIER 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.386 1.391 . . . . 0.0 111.104 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.555 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -104.82 -20.64 13.53 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -175.733 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.555 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.1 t . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 121.498 0.666 . . . . 0.0 111.723 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 . . . . . 0 C--O 1.237 0.395 0 CA-C-O 121.714 0.768 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -57.91 -26.29 62.0 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.305 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -15.65 2.87 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.915 -0.49 . . . . 0.0 111.394 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.595 ' CZ ' HD21 ' C' ' 774' ' ' LEU . 21.0 ttp180 -62.61 -46.12 89.73 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.858 -0.526 . . . . 0.0 109.898 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -59.15 -33.89 71.44 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.849 0.833 . . . . 0.0 109.043 178.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.54 66.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.721 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 8.4 p -58.44 -44.46 89.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.835 -0.541 . . . . 0.0 110.204 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.792 ' O ' HG22 ' A' ' 749' ' ' VAL . 1.9 mp -56.52 -20.9 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.245 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.724 ' HA ' HD22 ' C' ' 785' ' ' LEU . 67.6 mtp85 -59.14 -24.29 62.9 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.468 -0.77 . . . . 0.0 110.178 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.786 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -70.59 -17.87 62.9 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.984 -0.448 . . . . 0.0 111.576 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.792 HG22 ' O ' ' A' ' 746' ' ' ILE . 29.9 m -55.76 -54.91 21.06 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 O-C-N 120.793 -1.192 . . . . 0.0 110.78 -178.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.555 ' OD1' HD23 ' C' ' 785' ' ' LEU . 5.5 m120 -72.75 -21.42 61.02 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 173.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.68 30.82 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.699 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 3.3 p -57.92 -37.79 74.73 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.808 0.804 . . . . 0.0 109.261 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.9 tp -65.38 -49.48 69.15 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.98 -34.58 76.41 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.703 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.415 ' C ' HD23 ' A' ' 755' ' ' LEU . 7.0 tt -58.77 -44.85 90.74 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 122.013 -0.43 . . . . 0.0 111.477 -177.081 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 6.7 mm -63.04 -33.33 60.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.29 -30.02 68.01 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.494 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 30.5 m-20 -54.97 -47.13 74.97 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.672 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.58 -45.2 65.83 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.733 0.778 . . . . 0.0 111.043 178.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.458 ' HA ' HD11 ' A' ' 763' ' ' LEU . 24.2 mt -62.54 -29.58 70.67 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 44.7 mtt85 -81.07 -23.28 38.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 9.9 t -75.75 -46.83 28.71 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.88 -1.137 . . . . 0.0 111.955 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.531 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.0 OUTLIER -69.66 -54.37 14.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 764' ' ' SER . . . . . 0.4 ' O ' ' HB3' ' A' ' 765' ' ' LEU . 18.4 p -98.09 -36.97 9.92 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -176.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.555 HD22 ' O ' ' A' ' 765' ' ' LEU . 0.6 OUTLIER 73.35 -61.62 0.49 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.142 0.577 . . . . 0.0 110.745 -177.607 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 766' ' ' PHE . . . . . 0.536 ' HB2' HD13 ' A' ' 765' ' ' LEU . 40.7 t80 -139.13 -68.74 0.43 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.602 -0.686 . . . . 0.0 111.048 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.9 m -79.78 126.3 30.79 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.982 -0.449 . . . . 0.0 110.02 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.514 ' CE1' HD13 ' A' ' 771' ' ' LEU . 2.7 t80 -57.3 -20.42 28.16 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.967 0.413 . . . . 0.0 110.926 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.1 -40.19 95.02 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.982 0.896 . . . . 0.0 108.745 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -55.86 -29.22 59.54 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.268 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.514 HD13 ' CE1' ' A' ' 768' ' ' TYR . 8.6 tt -59.3 -38.47 80.31 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.957 -0.464 . . . . 0.0 111.608 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -64.63 -32.83 74.67 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.333 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.75 -42.42 99.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.091 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 763' ' ' LEU . 4.0 tp -58.45 -42.19 86.83 Favored 'General case' 0 C--N 1.354 0.776 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.346 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.4 tp -59.06 -36.86 75.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.017 0.437 . . . . 0.0 112.163 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 26.5 mt -74.57 -44.39 51.12 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.953 -0.467 . . . . 0.0 111.529 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 34.3 pt -68.4 -37.19 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 O-C-N 122.119 -0.363 . . . . 0.0 111.312 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.74 -46.6 96.19 Favored 'Isoleucine or valine' 0 C--N 1.345 0.387 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.166 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 782' ' ' VAL . 36.7 p -64.66 -36.71 85.14 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.872 0.844 . . . . 0.0 110.813 177.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -43.87 77.24 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.71 HD11 ' CG2' ' B' ' 746' ' ' ILE . 35.3 pt -69.97 -36.73 70.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 779' ' ' THR . 21.3 m -55.76 -38.05 49.54 Favored 'Isoleucine or valine' 0 C--N 1.359 1.019 0 CA-C-N 119.427 1.012 . . . . 0.0 109.117 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.08 -50.36 69.35 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 121.826 0.822 . . . . 0.0 110.112 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.5 -41.03 98.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.86 -26.88 64.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.339 0.59 . . . . 0.0 111.188 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -65.46 -13.24 58.11 Favored Glycine 0 CA--C 1.537 1.414 0 O-C-N 122.06 -0.4 . . . . 0.0 112.493 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 26.9 mtm105 -68.77 136.04 52.18 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.822 -0.81 . . . . 0.0 109.881 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.631 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.6 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.666 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.666 HD22 ' C ' ' B' ' 660' ' ' LEU . 0.4 OUTLIER 60.2 124.12 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.173 0.511 . . . . 0.0 110.598 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 662' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' B' ' 663' ' ' LEU . 0.4 OUTLIER -174.64 29.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.604 -0.685 . . . . 0.0 112.025 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.592 HD12 HD13 ' C' ' 660' ' ' LEU . 0.3 OUTLIER 75.06 -42.74 0.49 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.799 0.809 . . . . 0.0 109.657 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.539 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.7 t70 -79.98 -31.87 39.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.762 0.792 . . . . 0.0 109.874 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.53 -41.54 79.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.507 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.592 ' CE2' HD12 ' B' ' 661' ' ' LEU . 89.1 m95 -75.02 -46.51 34.54 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.338 0.589 . . . . 0.0 111.534 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.29 71.19 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.87 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 88.3 p -62.76 -33.48 75.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.977 0.417 . . . . 0.0 111.474 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.82 -32.02 70.26 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.297 0.57 . . . . 0.0 111.081 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -62.55 -23.26 66.89 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.899 0.381 . . . . 0.0 111.918 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -81.79 -13.06 58.22 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.897 0.38 . . . . 0.0 111.813 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -69.98 -46.69 64.66 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.48 0.657 . . . . 0.0 110.903 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 47.8 t80 57.26 34.39 24.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.73 0.776 . . . . 0.0 110.939 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -140.7 -87.53 0.18 Allowed 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.781 -0.574 . . . . 0.0 111.139 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.408 HG12 ' CE3' ' B' ' 678' ' ' TRP . 18.5 tt -68.2 -35.98 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 O-C-N 121.57 -0.706 . . . . 0.0 112.178 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.2 m -50.38 -32.5 17.68 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.714 -0.616 . . . . 0.0 111.545 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -55.96 -44.86 78.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.625 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -60.61 -43.7 97.14 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.838 0.828 . . . . 0.0 108.905 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.1 tp -57.86 -40.11 79.38 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.815 -178.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -100.85 -3.05 30.55 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -101.47 -23.14 14.38 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.589 -0.694 . . . . 0.0 112.164 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.625 HG23 ' O ' ' B' ' 678' ' ' TRP . 28.8 pt -60.44 -35.83 65.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 O-C-N 121.875 -0.516 . . . . 0.0 110.494 178.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 22.3 ttt-85 -53.31 -47.2 69.46 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.792 -0.568 . . . . 0.0 110.098 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.485 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.1 mp -75.21 -36.3 36.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.66 -27.66 66.58 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.874 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.47 -45.36 97.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.32 -43.57 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 97.0 mt -58.64 -37.74 67.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' B' ' 685' ' ' PHE . 45.5 t -61.69 -47.46 93.24 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.936 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.15 -27.06 13.8 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.774 -0.579 . . . . 0.0 112.205 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 37.0 m -60.63 -44.16 96.68 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.574 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.46 -32.39 70.19 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.154 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.574 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.5 OUTLIER -57.71 -44.58 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.301 -0.875 . . . . 0.0 108.694 -178.731 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.46 -31.55 77.88 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 178.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.615 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.18 -37.82 67.55 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 122.065 0.936 . . . . 0.0 109.467 178.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.512 HH11 HD11 ' A' ' 693' ' ' ILE . 24.0 mmt180 -55.65 -28.55 56.04 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.638 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.02 -35.95 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 121.022 -1.048 . . . . 0.0 108.943 -178.987 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.615 HG12 ' O ' ' B' ' 695' ' ' LEU . 1.2 p -66.04 -30.2 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 O-C-N 121.901 -0.5 . . . . 0.0 110.269 177.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 3.4 m-85 -56.12 -30.71 62.49 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.828 -0.545 . . . . 0.0 109.532 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.81 77.29 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 177.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.38 -38.14 76.74 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.451 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 9.2 tp -58.72 -43.67 90.2 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.069 -0.395 . . . . 0.0 110.281 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 80.3 p -63.82 -31.72 73.0 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.778 0.799 . . . . 0.0 109.839 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -47.29 83.99 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 122.531 1.157 . . . . 0.0 109.142 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.465 ' HA ' HD13 ' B' ' 748' ' ' LEU . 56.1 t -70.19 -45.18 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.631 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.82 -36.04 81.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.143 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.442 HH21 ' HG3' ' B' ' 707' ' ' ARG . 4.6 ttm-85 -63.11 -49.28 75.04 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.524 1.154 . . . . 0.0 109.772 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.453 HG21 ' HD3' ' C' ' 714' ' ' PRO . 2.2 t -77.28 -44.82 30.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 114.27 -1.332 . . . . 0.0 114.183 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -70.22 -45.02 67.39 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -175.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.9 pt20 -104.97 -22.96 13.04 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 127.94 177.43 14.86 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 712' ' ' TYR . . . . . 0.48 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.0 p90 -129.97 -69.45 0.67 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 21.8 m -62.24 159.36 40.03 Favored Pre-proline 0 N--CA 1.467 0.391 0 O-C-N 121.312 -0.867 . . . . 0.0 109.24 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.412 ' HD2' HG21 ' A' ' 708' ' ' VAL . 37.8 Cg_exo -34.26 102.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.16 1.907 . . . . 0.0 111.884 -178.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.458 ' O ' ' C ' ' B' ' 716' ' ' SER . 0.5 OUTLIER -76.28 -20.0 57.75 Favored 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -175.393 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.458 ' C ' ' O ' ' B' ' 715' ' ' LEU . 77.6 p . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.524 0.678 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.16 -26.51 62.11 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -178.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -13.13 57.68 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.07 71.21 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 121.034 -1.041 . . . . 0.0 112.124 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.44 -45.27 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.28 -37.07 71.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.178 0.513 . . . . 0.0 110.208 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 745' ' ' SER . . . . . 0.407 ' HB3' HG12 ' B' ' 708' ' ' VAL . 52.8 m -57.13 -34.09 68.04 Favored 'General case' 0 C--O 1.231 0.084 0 CA-C-O 120.992 0.425 . . . . 0.0 110.49 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.71 ' CG2' HD11 ' A' ' 781' ' ' ILE . 23.1 mt -57.68 -16.08 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.66 -33.51 71.64 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 177.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' B' ' 705' ' ' VAL . 0.4 OUTLIER -55.73 -16.16 3.97 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.668 178.643 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 39.6 t -55.77 -53.69 34.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 177.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -72.1 -19.93 61.72 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.084 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.87 31.53 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.834 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.22 -37.64 75.23 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.956 -0.732 . . . . 0.0 109.379 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.0 -48.58 57.58 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 108.945 177.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.71 -34.84 73.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.805 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.03 -42.93 91.4 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.992 0.425 . . . . 0.0 111.233 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 46.6 mm -67.77 -35.62 73.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.51 -33.53 74.3 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.449 ' OD2' HD23 ' C' ' 715' ' ' LEU . 10.0 m-20 -55.92 -47.99 76.49 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.208 -0.933 . . . . 0.0 108.889 179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.45 -45.13 66.41 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.088 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -46.07 90.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -81.87 -25.4 35.09 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.9 p -71.23 -46.45 61.07 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.944 -1.098 . . . . 0.0 111.648 -177.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.684 ' O ' HD22 ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.45 -54.59 13.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -179.732 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.85 -33.94 10.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 68.52 88.42 0.11 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.743 0.782 . . . . 0.0 109.95 -176.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 58.98 -86.16 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.036 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -79.85 162.23 25.17 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 121.405 -0.809 . . . . 0.0 110.684 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -92.62 25.29 3.13 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.218 0.533 . . . . 0.0 111.479 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -90.98 -41.89 10.85 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.833 0.825 . . . . 0.0 109.149 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -29.46 70.34 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.32 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.37 -34.12 72.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -60.84 -43.18 98.63 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -69.56 -38.4 77.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.714 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.3 OUTLIER -67.34 -38.03 84.22 Favored 'General case' 0 C--N 1.344 0.341 0 O-C-N 121.659 -0.65 . . . . 0.0 111.308 -179.655 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 20.0 mt -58.67 -37.17 75.43 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.577 -0.702 . . . . 0.0 111.665 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 776' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 779' ' ' THR . 1.2 pp -74.11 -34.29 63.88 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.73 -0.607 . . . . 0.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 777' ' ' ILE . . . . . 0.622 HD11 ' HG ' ' B' ' 774' ' ' LEU . 10.2 pt -70.39 -36.27 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.076 -1.015 . . . . 0.0 110.005 177.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 774' ' ' LEU . 57.9 t -55.11 -46.29 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.678 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.1 t -63.95 -35.64 81.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.484 -0.76 . . . . 0.0 109.581 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 9.7 tpt85 -61.27 -31.88 71.7 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.974 -0.454 . . . . 0.0 110.886 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.687 HG21 HG22 ' C' ' 746' ' ' ILE . 7.1 mm -61.19 -48.04 90.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 O-C-N 122.047 -0.408 . . . . 0.0 110.642 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.678 HG22 ' O ' ' B' ' 779' ' ' THR . 6.2 m -55.31 -38.22 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.504 -0.748 . . . . 0.0 111.11 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.61 -52.24 66.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.404 0.621 . . . . 0.0 110.76 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.1 -44.03 66.47 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.605 0.717 . . . . 0.0 111.966 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.466 HD22 ' OD1' ' C' ' 750' ' ' ASN . 0.1 OUTLIER -73.16 -14.56 61.39 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.682 -178.668 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -54.45 -40.88 70.77 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 11.5 ptp85 -100.93 130.55 46.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.334 0.587 . . . . 0.0 109.995 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.172 -0.918 . . . . 0.0 110.88 -179.228 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.592 HD13 HD12 ' B' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.125 0.488 . . . . 0.0 110.118 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.495 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.3 mp 60.45 123.02 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.723 0.773 . . . . 0.0 111.392 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 178.8 171.29 0.83 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.85 -49.35 76.98 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.174 0.988 . . . . 0.0 109.238 178.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -67.12 -23.07 65.78 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.561 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -48.73 12.06 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.361 0.601 . . . . 0.0 110.071 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -63.44 -45.21 91.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.553 0.692 . . . . 0.0 110.315 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.75 -18.01 65.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.98 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.37 -33.52 67.3 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.923 -0.486 . . . . 0.0 111.778 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.464 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -60.15 -33.95 72.87 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -62.03 -17.58 57.78 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 121.645 -0.659 . . . . 0.0 111.801 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -86.05 -25.21 26.03 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.244 0.545 . . . . 0.0 111.133 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.409 ' CE3' HG21 ' C' ' 675' ' ' ILE . 12.5 m95 -62.84 -40.71 98.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.526 0.679 . . . . 0.0 110.237 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 58.35 34.67 24.23 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.093 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -161.03 -69.08 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.531 -0.731 . . . . 0.0 112.274 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.716 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -59.07 -37.81 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 111.168 -178.832 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.72 -33.91 50.13 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.977 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 677' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' C' ' 681' ' ' TYR . 10.2 m120 -65.69 -50.41 65.0 Favored 'General case' 0 C--O 1.223 -0.332 0 O-C-N 121.927 -0.483 . . . . 0.0 110.722 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.465 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -65.47 -44.24 87.8 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.489 0.661 . . . . 0.0 109.797 178.764 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.628 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.14 -35.63 81.41 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.884 -178.708 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -101.53 -9.77 20.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 681' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' C' ' 677' ' ' ASN . 3.1 m-85 -92.09 -21.37 20.49 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.475 -0.765 . . . . 0.0 111.201 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.545 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.2 pt -60.71 -37.05 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.822 0.344 . . . . 0.0 110.16 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 -56.9 -47.3 80.84 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.481 0.658 . . . . 0.0 109.798 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.17 -34.16 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -60.68 -29.91 69.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.469 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.868 HG21 HD12 ' A' ' 686' ' ' ILE . 10.0 mm -60.84 -47.89 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.429 0.633 . . . . 0.0 109.415 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -61.62 -40.38 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.82 -37.68 67.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.536 HG23 ' O ' ' C' ' 685' ' ' PHE . 85.0 t -55.61 -41.12 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.55 -40.35 77.92 Favored Glycine 0 C--N 1.345 1.067 0 N-CA-C 108.813 -1.715 . . . . 0.0 108.813 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.1 -40.23 86.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.052 0.93 . . . . 0.0 109.373 177.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.403 HD23 HG12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -60.56 -46.68 89.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.576 -178.121 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.8 pp -68.53 -41.91 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 121.25 0.548 . . . . 0.0 110.375 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.609 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.28 -32.32 76.44 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 178.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.655 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.8 tt -60.08 -37.46 79.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.062 0.934 . . . . 0.0 110.158 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -55.98 -28.57 57.69 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.609 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.56 -35.42 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.254 -0.904 . . . . 0.0 110.644 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.668 ' O ' HG22 ' C' ' 701' ' ' VAL . 7.5 p -53.97 -29.23 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.728 -0.607 . . . . 0.0 110.621 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -54.9 -29.3 55.55 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.732 -0.605 . . . . 0.0 110.533 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.07 -37.63 74.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.668 HG22 ' O ' ' C' ' 698' ' ' VAL . 3.2 m -68.87 -35.77 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-O 121.645 0.736 . . . . 0.0 109.372 177.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.12 -37.88 84.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.035 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 22.0 m -62.97 -36.35 83.2 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.248 0.547 . . . . 0.0 110.408 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.1 -40.67 94.88 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.304 1.05 . . . . 0.0 108.841 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.434 HG22 HD23 ' C' ' 748' ' ' LEU . 87.3 t -65.36 -45.1 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 706' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 3.2 m120 -63.05 -36.91 85.15 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.021 0.915 . . . . 0.0 110.793 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.417 ' HD3' ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -60.04 -51.21 70.61 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.353 1.073 . . . . 0.0 110.596 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -78.3 -45.96 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.555 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.52 -40.24 61.88 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 710' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' C' ' 706' ' ' ASN . 0.0 OUTLIER -101.79 -21.44 14.6 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-O 121.665 0.745 . . . . 0.0 112.347 -176.572 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.46 -170.46 18.4 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -134.51 -53.36 0.83 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.863 -0.786 . . . . 0.0 112.059 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.446 ' HA ' HG21 ' B' ' 708' ' ' VAL . 0.9 OUTLIER -73.55 145.76 85.26 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.178 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 714' ' ' PRO . . . . . 0.453 ' HD3' HG21 ' B' ' 708' ' ' VAL . 71.2 Cg_exo -36.07 110.25 0.07 OUTLIER 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.268 1.979 . . . . 0.0 112.397 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.507 ' N ' HD22 ' C' ' 715' ' ' LEU . 2.9 mm? -74.35 -20.03 60.24 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -177.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 716' ' ' SER . . . . . 0.468 ' C ' ' O ' ' C' ' 715' ' ' LEU . 67.7 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 122.058 0.932 . . . . 0.0 113.082 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 122.151 0.976 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -58.52 -26.31 63.36 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.095 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -55.23 -10.42 0.56 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -75.76 -27.74 58.18 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.549 -0.72 . . . . 0.0 111.687 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -58.55 -44.07 89.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.389 0.614 . . . . 0.0 109.786 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -71.16 -36.08 71.88 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 745' ' ' SER . . . . . 0.717 ' O ' HD12 ' C' ' 748' ' ' LEU . 9.6 t -56.78 -38.71 72.88 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.687 HG22 HG21 ' B' ' 781' ' ' ILE . 6.0 mt -52.97 -22.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.84 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -59.35 -27.6 66.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.761 HD13 ' N ' ' C' ' 749' ' ' VAL . 0.0 OUTLIER -57.03 -22.54 39.65 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 122.185 -0.322 . . . . 0.0 111.606 179.247 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 749' ' ' VAL . . . . . 0.761 ' N ' HD13 ' C' ' 748' ' ' LEU . 83.5 t -55.41 -54.25 27.22 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.466 ' OD1' HD22 ' B' ' 785' ' ' LEU . 6.7 m120 -72.77 -32.03 65.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.166 -1.379 . . . . 0.0 108.792 174.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.46 -20.65 38.52 Favored Glycine 0 C--N 1.341 0.834 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.806 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 80.6 p -58.77 -37.97 77.45 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.766 -0.843 . . . . 0.0 109.025 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.8 tp -67.34 -48.15 68.37 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.764 0.792 . . . . 0.0 109.986 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.14 77.13 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.427 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.7 tt -59.29 -45.32 91.59 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.858 -0.526 . . . . 0.0 111.976 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 3.2 pt -73.96 -32.88 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.32 0.581 . . . . 0.0 109.822 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -69.29 -30.32 68.39 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.805 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -55.71 -49.01 74.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.347 -0.846 . . . . 0.0 109.907 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -70.2 -44.45 68.66 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.362 0.601 . . . . 0.0 111.29 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.4 -40.6 97.01 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 111.463 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -78.45 -32.81 48.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.022 0.439 . . . . 0.0 111.405 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 37.5 t -66.63 -43.27 85.13 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.282 1.039 . . . . 0.0 110.063 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.495 HD23 HD11 ' C' ' 771' ' ' LEU . 3.2 tp -64.88 -53.57 44.59 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.08 -0.964 . . . . 0.0 113.387 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.532 ' HB2' HD12 ' C' ' 771' ' ' LEU . 23.3 t -97.82 -20.51 17.48 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 64.29 -75.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.745 0.307 . . . . 0.0 110.5 -177.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -108.5 -72.93 0.7 Allowed 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.476 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 23.6 t -133.86 175.71 9.21 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.518 0.675 . . . . 0.0 111.332 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -58.39 -38.3 77.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.152 0.501 . . . . 0.0 110.584 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -53.34 -46.49 69.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 122.105 0.955 . . . . 0.0 108.8 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 48.2 ttm-85 -72.45 -29.57 63.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.953 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' C' ' 764' ' ' SER . 7.5 tt -58.68 -29.66 66.78 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -178.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -56.39 -32.69 65.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -69.36 -34.52 74.7 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 118.382 -1.327 . . . . 0.0 109.666 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.595 HD21 ' CZ ' ' A' ' 742' ' ' ARG . 0.2 OUTLIER -59.93 -38.42 82.33 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.35 -36.08 72.9 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.324 1.059 . . . . 0.0 108.304 176.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -37.6 65.82 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.221 178.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.591 HD12 HD22 ' C' ' 774' ' ' LEU . 23.1 mt -63.64 -44.92 98.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.501 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.565 ' O ' HG13 ' C' ' 782' ' ' VAL . 34.5 m -66.25 -40.86 87.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.229 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.425 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.1 m -63.14 -47.14 84.0 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.984 0.421 . . . . 0.0 111.881 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -39.23 83.93 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.813 -0.554 . . . . 0.0 111.871 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.405 ' HB ' HG21 ' A' ' 746' ' ' ILE . 94.3 mt -68.95 -41.94 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.768 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.781 HG12 HG21 ' A' ' 749' ' ' VAL . 26.4 m -55.89 -38.05 50.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.744 0 CA-C-N 119.773 1.169 . . . . 0.0 109.418 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -64.93 -42.16 94.92 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-O 121.699 0.762 . . . . 0.0 110.052 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 11.9 tp -69.47 -35.61 75.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.301 0.572 . . . . 0.0 111.502 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.724 HD22 ' HA ' ' A' ' 747' ' ' ARG . 26.7 tp -76.72 -28.32 55.77 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.413 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.42 -36.95 6.13 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -106.04 137.72 43.48 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.339 -0.507 . . . . 0.0 110.175 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.437 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.444 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.586 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 28.1 mt 77.61 112.23 0.07 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.989 0.9 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -176.29 -175.76 0.72 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.507 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.2 tt -56.07 -42.17 76.27 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.61 -0.681 . . . . 0.0 110.216 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.02 -34.48 64.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.125 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -73.96 -46.03 46.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.105 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -70.03 -45.95 66.1 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.976 0.417 . . . . 0.0 110.934 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.78 -26.55 65.27 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.985 0.421 . . . . 0.0 111.886 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.6 m -69.29 -32.26 71.29 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.292 0.568 . . . . 0.0 111.195 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.47 -31.71 72.48 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.447 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -59.61 -21.95 61.13 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.031 0.443 . . . . 0.0 111.267 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -75.09 -20.75 59.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.093 0.473 . . . . 0.0 111.432 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.83 -42.57 99.19 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.436 0.636 . . . . 0.0 110.973 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.4 t80 60.22 39.75 18.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.838 0.828 . . . . 0.0 110.848 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -160.98 -67.2 0.06 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.842 -0.536 . . . . 0.0 111.296 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.19 -37.13 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 122.131 -0.356 . . . . 0.0 111.83 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.0 m -52.31 -34.36 46.66 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -177.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -65.02 -49.89 68.41 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 121.507 0.67 . . . . 0.0 109.83 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.4 t90 -65.6 -41.22 93.02 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.675 0.75 . . . . 0.0 110.146 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.423 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -66.17 -36.44 83.11 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.283 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -94.56 -40.16 10.0 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -74.12 -2.7 25.65 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.692 -0.63 . . . . 0.0 112.556 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.685 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.98 -36.94 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 121.646 -0.659 . . . . 0.0 110.284 179.458 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.685 ' H ' HD12 ' A' ' 682' ' ' ILE . 5.9 ttt-85 -59.49 -47.26 86.19 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.009 -0.432 . . . . 0.0 110.584 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.411 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -66.76 -34.6 71.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.42 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.4 OUTLIER -59.95 -32.05 70.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.483 -179.544 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 1.004 HD12 HG21 ' C' ' 686' ' ' ILE . 15.7 mm -60.61 -46.73 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.988 0.423 . . . . 0.0 110.216 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 83.8 mt -60.78 -40.36 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.92 -37.03 70.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.107 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 685' ' ' PHE . 97.9 t -54.58 -40.02 48.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.6 -39.94 95.75 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.9 m -63.4 -38.44 91.14 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.806 0.812 . . . . 0.0 109.694 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.6 -43.95 93.55 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.327 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.866 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -68.31 -42.05 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.007 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.03 -22.5 57.94 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.91 -37.72 85.69 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.999 0.904 . . . . 0.0 109.306 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 2.4 mmt180 -55.51 -28.16 53.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.569 0.748 . . . . 0.0 111.618 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.03 -39.19 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 O-C-N 121.292 -0.88 . . . . 0.0 108.794 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.805 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.53 -31.26 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 O-C-N 121.582 -0.699 . . . . 0.0 110.184 177.219 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.422 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 3.1 m-85 -56.01 -28.91 59.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.962 0.411 . . . . 0.0 110.607 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.48 -37.43 72.91 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.805 HG22 ' O ' ' A' ' 698' ' ' VAL . 10.3 m -59.29 -35.87 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.539 0.685 . . . . 0.0 109.313 177.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.4 -37.81 62.82 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.525 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.5 m -62.65 -39.49 94.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.607 0.718 . . . . 0.0 110.091 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.576 HD22 HH22 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.03 -41.93 97.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.558 1.17 . . . . 0.0 108.804 178.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 99.0 t -68.87 -37.07 76.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.317 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -62.56 -39.92 95.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.034 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.576 HH22 HD22 ' A' ' 704' ' ' LEU . 5.2 ttm105 -57.36 -48.44 79.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 122.348 1.071 . . . . 0.0 110.349 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -72.94 -44.53 57.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.022 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -73.33 -14.47 61.3 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -178.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -99.62 8.35 44.47 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 73.14 20.79 80.06 Favored Glycine 0 CA--C 1.541 1.687 0 O-C-N 121.665 -0.647 . . . . 0.0 112.131 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 68.22 -129.29 0.12 Allowed 'General case' 0 CA--C 1.568 1.635 0 O-C-N 121.868 -0.783 . . . . 0.0 111.272 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 5.5 p -62.62 159.26 44.54 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 120.974 -1.078 . . . . 0.0 111.206 -178.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -45.15 97.96 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.46 1.44 . . . . 0.0 112.127 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.61 -20.41 16.35 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.423 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.85 0 O-C-N 121.766 -0.584 . . . . 0.0 112.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 121.917 0.865 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.7 mtt-85 -58.63 -26.33 63.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.746 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -54.85 -16.97 3.02 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.8 -0.563 . . . . 0.0 111.225 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.532 ' O ' HD12 ' A' ' 746' ' ' ILE . 53.1 ttp85 -74.79 -46.01 39.75 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.759 -0.588 . . . . 0.0 110.527 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.91 -45.14 93.51 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.504 0.669 . . . . 0.0 110.587 -178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.41 -36.56 71.38 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 745' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 748' ' ' LEU . 98.0 p -62.22 -36.14 81.03 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.703 HG12 HG12 ' C' ' 778' ' ' VAL . 1.2 mp -55.79 -46.76 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 120.577 -1.327 . . . . 0.0 110.283 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.653 ' HB3' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -64.41 -2.2 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.758 -177.165 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.65 ' O ' HD13 ' A' ' 748' ' ' LEU . 1.7 tm? -59.33 -15.53 16.82 Favored 'General case' 0 C--N 1.368 1.398 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 746' ' ' ILE 0.304 2.0 t -53.12 -54.0 19.57 Favored 'Isoleucine or valine' 0 C--N 1.345 0.375 0 C-N-CA 125.13 1.372 . . . . 0.0 107.439 178.478 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.467 ' OD1' HG12 ' A' ' 749' ' ' VAL . 6.4 m120 -73.32 -14.34 61.28 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.324 175.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.608 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -57.16 -19.41 31.54 Favored Glycine 0 C--O 1.222 -0.622 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.519 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 94.0 p -57.64 -37.86 74.06 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 117.803 0.801 . . . . 0.0 109.147 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.4 tp -62.55 -51.07 68.84 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.8 -35.14 79.63 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 112.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.4 tt -59.48 -45.45 91.61 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.002 -0.436 . . . . 0.0 111.963 -177.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.2 mt -61.84 -33.52 58.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.2 -30.49 68.68 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.536 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 5.1 m-20 -55.68 -48.93 74.23 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.319 -0.863 . . . . 0.0 109.271 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -70.64 -43.46 69.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.405 0.622 . . . . 0.0 111.757 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.42 -32.97 74.81 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.308 0.575 . . . . 0.0 112.114 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -74.42 -18.55 60.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.2 t -77.37 -46.4 22.93 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.579 -0.7 . . . . 0.0 111.634 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.745 ' HA ' HD13 ' A' ' 774' ' ' LEU . 8.0 mp -69.09 -55.82 9.59 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -47.24 5.19 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.255 1.026 . . . . 0.0 112.15 -178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.431 ' O ' HD23 ' A' ' 765' ' ' LEU . 3.6 tt 84.22 -52.96 0.12 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.464 -176.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -134.43 -72.6 0.48 Allowed 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.78 -0.575 . . . . 0.0 110.668 178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.9 152.93 19.83 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.884 -0.51 . . . . 0.0 110.323 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.511 ' CE2' HD13 ' A' ' 771' ' ' LEU . 0.2 OUTLIER -67.03 -24.86 66.05 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.942 0.401 . . . . 0.0 110.897 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.18 -42.19 65.99 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.731 0.777 . . . . 0.0 109.54 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -62.95 -30.08 71.29 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.114 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.511 HD13 ' CE2' ' A' ' 768' ' ' TYR . 2.8 tt -59.87 -42.4 93.63 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.859 -0.525 . . . . 0.0 109.709 -178.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -64.72 -33.51 76.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.658 0.742 . . . . 0.0 109.236 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -43.44 98.82 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.919 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.745 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.7 tt -58.38 -38.46 77.36 Favored 'General case' 0 C--N 1.349 0.544 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.172 -179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 13.1 mt -58.44 -36.88 74.34 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.774 -0.579 . . . . 0.0 112.028 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.8 -43.07 72.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.914 -0.491 . . . . 0.0 112.173 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 20.5 pt -65.19 -37.69 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.466 ' HA ' HD12 ' A' ' 781' ' ' ILE . 73.0 t -56.09 -45.42 80.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 O-C-N 121.98 -0.45 . . . . 0.0 110.631 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.827 ' O ' HG22 ' A' ' 782' ' ' VAL . 19.9 p -63.62 -48.39 77.49 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.023 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -67.54 -31.34 71.37 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.629 ' CD1' HD13 ' B' ' 746' ' ' ILE . 36.8 mt -53.66 -36.21 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.827 HG22 ' O ' ' A' ' 779' ' ' THR . 5.2 m -55.63 -37.99 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.368 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -65.45 -44.68 86.51 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 121.503 0.668 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 13.1 tp -69.45 -38.2 77.68 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.158 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.97 -27.23 26.62 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.0 0.429 . . . . 0.0 111.475 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.66 -31.9 3.98 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -89.91 111.37 22.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.67 0.747 . . . . 0.0 110.246 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.799 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.581 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.5 mm? 63.53 119.6 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.624 0.726 . . . . 0.0 110.055 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 178.57 177.55 0.45 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.479 0.657 . . . . 0.0 110.172 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.485 HD23 ' N ' ' B' ' 664' ' ' ASP . 9.5 tt -48.94 -62.52 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.793 0.806 . . . . 0.0 111.379 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.485 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.0 t70 -64.78 -21.16 66.72 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.408 -178.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -79.97 -43.91 21.19 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.924 -0.485 . . . . 0.0 110.677 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -64.81 -46.09 83.47 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.665 0.745 . . . . 0.0 109.964 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.09 -23.74 67.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.771 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 42.8 p -68.45 -30.84 69.79 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.838 -0.539 . . . . 0.0 111.274 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.0 -33.19 72.86 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.485 0.659 . . . . 0.0 110.779 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 64.3 m95 -59.57 -18.87 44.43 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.366 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -84.92 -29.5 25.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.343 0.592 . . . . 0.0 110.744 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.7 m95 -57.6 -47.56 81.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.354 0.597 . . . . 0.0 110.74 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 18.8 t80 59.52 28.11 17.43 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.334 0.588 . . . . 0.0 111.323 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -138.68 -78.23 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.83 -0.544 . . . . 0.0 111.069 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -64.64 -36.98 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.681 -0.637 . . . . 0.0 111.254 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.81 -34.31 39.6 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.073 -0.392 . . . . 0.0 111.916 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -63.36 -50.15 71.08 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 109.575 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.624 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.6 t90 -65.65 -40.58 92.61 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-O 121.889 0.852 . . . . 0.0 109.879 178.152 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -35.68 81.61 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.322 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -101.83 -47.01 4.74 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -59.0 -15.1 11.45 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.61 -0.681 . . . . 0.0 112.224 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.783 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.3 pp -60.56 -36.28 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.623 -0.673 . . . . 0.0 110.459 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 683' ' ' ARG . . . . . 0.783 ' N ' HD12 ' B' ' 682' ' ' ILE . 12.9 ttt-85 -53.85 -47.39 71.01 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.442 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -68.68 -37.34 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -28.25 67.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.786 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.707 HD12 HG21 ' A' ' 686' ' ' ILE . 16.9 mm -60.7 -49.6 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 O-C-N 121.781 -0.575 . . . . 0.0 109.924 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.37 -39.59 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.09 -37.95 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.66 -48.4 87.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.16 -26.75 9.51 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 7.4 m -60.06 -43.85 95.14 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.579 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.56 -31.84 69.8 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.413 -0.805 . . . . 0.0 112.374 -177.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.579 ' N ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.05 -46.13 84.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.452 -0.78 . . . . 0.0 109.757 -177.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.73 -31.36 77.79 Favored Glycine 0 CA--C 1.54 1.624 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.455 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.08 -37.19 66.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.906 0.86 . . . . 0.0 110.434 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.866 ' HE ' HD11 ' A' ' 693' ' ' ILE . 17.3 mmt180 -55.14 -28.23 51.17 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.703 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.53 -36.55 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 O-C-N 120.813 -1.179 . . . . 0.0 108.665 -178.208 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.455 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.4 -30.84 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.418 -0.801 . . . . 0.0 109.65 176.472 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.7 m-85 -56.37 -30.64 62.95 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.759 -0.588 . . . . 0.0 109.724 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.64 -37.4 75.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -43.16 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -59.69 -37.97 80.28 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.121 0.486 . . . . 0.0 109.767 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.3 m -62.76 -32.96 74.21 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.219 0.533 . . . . 0.0 109.594 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.1 OUTLIER -64.18 -40.59 96.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.052 0.929 . . . . 0.0 108.617 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.495 HG22 HD22 ' B' ' 748' ' ' LEU . 58.6 t -67.88 -46.17 82.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.564 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.87 -36.61 83.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.8 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.34 -50.18 55.11 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -41.98 30.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.645 0.736 . . . . 0.0 112.434 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -58.01 -44.99 87.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.514 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.413 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.2 pt20 -104.61 -25.0 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.333 1.063 . . . . 0.0 113.24 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.95 153.55 8.0 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.511 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -85.85 -33.24 21.35 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 122.05 -0.676 . . . . 0.0 112.135 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.02 155.43 52.49 Favored Pre-proline 0 N--CA 1.471 0.601 0 CA-C-O 118.454 -0.784 . . . . 0.0 109.663 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 708' ' ' VAL . 59.8 Cg_exo -36.83 138.24 0.23 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.809 1.673 . . . . 0.0 112.285 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' B' ' 716' ' ' SER . 11.4 tp -100.55 -19.3 16.22 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 715' ' ' LEU . 6.9 t . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 122.346 1.07 . . . . 0.0 112.756 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.547 0.833 0 CA-C-O 122.045 0.926 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 3.1 ttp85 -72.42 -26.22 61.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.898 0.856 . . . . 0.0 111.454 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.32 -6.09 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -176.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.829 ' O ' HD12 ' B' ' 746' ' ' ILE . 60.8 mtm-85 -55.33 -39.11 69.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.248 0.931 . . . . 0.0 110.492 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.16 -43.72 87.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.165 0.507 . . . . 0.0 109.82 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.3 -42.86 68.14 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.567 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 93.8 p -56.54 -37.75 70.93 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.862 -0.524 . . . . 0.0 110.903 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.829 HD12 ' O ' ' B' ' 742' ' ' ARG . 1.4 mp -58.99 -10.28 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.836 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.429 ' HD2' ' HG3' ' C' ' 714' ' ' PRO . 0.0 OUTLIER -59.0 -27.11 65.12 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 121.211 -0.93 . . . . 0.0 108.863 177.683 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.495 HD22 HG22 ' B' ' 705' ' ' VAL . 33.9 tp -54.47 -21.91 11.27 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.643 -177.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 92.4 t -55.39 -54.29 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -73.02 -24.7 60.76 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.282 174.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.95 -19.76 31.25 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.025 -0.989 . . . . 0.0 113.159 -176.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 35.6 t -58.17 -37.63 75.08 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.387 1.094 . . . . 0.0 108.993 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 33.1 tp -69.27 -51.07 41.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.152 0.501 . . . . 0.0 110.595 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.63 76.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.78 -45.37 92.51 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.574 -0.704 . . . . 0.0 111.852 -176.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 756' ' ' ILE . . . . . 0.41 HG22 HD12 ' B' ' 760' ' ' LEU . 32.1 mm -64.99 -31.2 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.584 0.707 . . . . 0.0 109.24 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.39 68.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.947 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.21 -49.15 72.67 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.295 -0.878 . . . . 0.0 108.755 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.67 -44.6 66.69 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.455 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 760' ' ' LEU . . . . . 0.41 HD12 HG22 ' B' ' 756' ' ' ILE . 24.6 mt -68.1 -46.27 71.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -177.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -63.38 -42.77 98.86 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 762' ' ' SER . . . . . 0.406 ' O ' HD22 ' B' ' 774' ' ' LEU . 2.1 p -68.42 -45.45 72.58 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.443 0.639 . . . . 0.0 111.073 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.446 HD23 HD11 ' B' ' 771' ' ' LEU . 0.2 OUTLIER -68.67 -53.75 20.45 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.829 -0.544 . . . . 0.0 112.39 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.9 p -98.03 -49.35 4.79 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 76.89 92.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.898 0.856 . . . . 0.0 110.412 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 3.1 t80 71.45 -72.93 0.1 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.177 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 19.2 p -98.67 163.28 12.71 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.743 -0.598 . . . . 0.0 111.376 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.87 -33.51 21.24 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.661 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.81 -38.11 64.23 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 122.167 0.984 . . . . 0.0 109.156 178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 9.6 tpt85 -59.27 -29.64 67.72 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.856 178.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.446 HD11 HD23 ' B' ' 763' ' ' LEU . 8.0 tt -59.61 -37.73 79.39 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 110.706 -178.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -58.53 -35.62 72.57 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.128 0.49 . . . . 0.0 110.081 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -69.25 -48.98 60.32 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.138 0.494 . . . . 0.0 110.188 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.413 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.1 OUTLIER -61.4 -37.73 84.5 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.747 0.784 . . . . 0.0 110.137 179.539 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.62 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.6 OUTLIER -57.69 -36.92 72.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.58 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.15 -33.28 69.9 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 122.19 -0.319 . . . . 0.0 111.45 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 6.3 pt -70.15 -36.88 69.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 O-C-N 121.839 -0.538 . . . . 0.0 110.317 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.413 HG23 ' O ' ' B' ' 774' ' ' LEU . 41.6 t -59.72 -46.19 93.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 O-C-N 121.526 -0.734 . . . . 0.0 110.344 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.791 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.2 t -63.33 -48.18 79.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.934 -0.479 . . . . 0.0 112.226 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.5 -31.68 71.96 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.756 -0.59 . . . . 0.0 111.445 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 22.6 mt -58.34 -36.32 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 121.88 -0.513 . . . . 0.0 110.652 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.791 HG22 ' O ' ' B' ' 779' ' ' THR . 5.9 m -53.87 -38.26 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 O-C-N 121.593 -0.692 . . . . 0.0 110.246 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.28 -41.61 96.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.4 0.619 . . . . 0.0 110.573 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.73 -44.13 97.5 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.295 0.569 . . . . 0.0 110.954 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 30.3 tp -79.51 -24.95 41.91 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.007 0.432 . . . . 0.0 110.64 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.51 -43.04 10.43 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -97.78 113.66 25.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.686 0.755 . . . . 0.0 109.776 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.348 -178.564 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 122.398 1.094 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.54 169.26 24.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.884 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -174.58 167.41 3.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.572 0.701 . . . . 0.0 110.532 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.588 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.2 OUTLIER -56.2 -48.69 75.9 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.067 0.937 . . . . 0.0 109.375 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.588 ' N ' HD13 ' C' ' 663' ' ' LEU . 9.4 t70 -67.2 -28.96 68.51 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.396 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -71.22 -48.74 49.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.028 0.442 . . . . 0.0 111.018 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -56.84 -46.19 81.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.217 0.532 . . . . 0.0 110.486 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.35 85.65 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.185 0.516 . . . . 0.0 111.448 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 25.5 p -57.78 -34.5 69.65 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.138 0.495 . . . . 0.0 111.293 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 14.8 mt -60.52 -29.06 68.87 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.139 -0.351 . . . . 0.0 111.293 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 51.1 m95 -60.91 -21.11 63.05 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.909 -0.495 . . . . 0.0 110.993 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -84.98 -5.76 59.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 121.03 0.443 . . . . 0.0 111.352 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.43 ' O ' HG22 ' C' ' 675' ' ' ILE . 13.9 m95 -89.86 30.65 1.03 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.323 0.582 . . . . 0.0 110.617 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -16.56 135.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 91.52 -48.93 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.688 1.595 . . . . 0.0 111.651 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.662 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.82 -42.39 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.535 0.683 . . . . 0.0 111.571 -179.34 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.73 -33.69 49.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.568 -178.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -60.11 -49.92 75.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.391 0.615 . . . . 0.0 109.704 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.8 OUTLIER -65.81 -42.76 90.25 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.685 0.755 . . . . 0.0 109.693 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.466 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -63.31 -35.8 81.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.391 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -101.61 -23.27 14.29 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -83.09 -16.07 48.33 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.374 -0.829 . . . . 0.0 112.22 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.5 pp -60.53 -36.47 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 O-C-N 122.043 -0.411 . . . . 0.0 110.226 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.645 ' N ' HD12 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -59.88 -46.86 87.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.75 0.786 . . . . 0.0 109.789 179.397 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.434 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -73.18 -31.33 34.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 CA-C-O 121.423 0.63 . . . . 0.0 109.71 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -28.28 68.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.436 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 1.004 HG21 HD12 ' A' ' 686' ' ' ILE . 8.3 mm -61.79 -42.74 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 121.41 0.624 . . . . 0.0 109.562 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 66.4 mt -65.19 -37.64 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.92 -38.23 72.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 81.6 t -55.7 -40.41 60.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 690' ' ' GLY . . . . . 0.424 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.13 -40.43 74.42 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 177.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.6 m -66.35 -38.32 87.34 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.019 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.0 tp -60.21 -46.32 90.16 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.572 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.424 HG13 ' O ' ' C' ' 690' ' ' GLY . 1.9 pp -67.88 -41.8 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 O-C-N 121.928 -0.483 . . . . 0.0 111.005 -178.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.698 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.39 -26.57 64.36 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.9 tt -66.07 -38.74 89.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.938 0.875 . . . . 0.0 110.138 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.15 -28.69 58.97 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.698 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.2 tt -58.77 -35.36 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 O-C-N 121.416 -0.802 . . . . 0.0 110.99 -176.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.9 p -53.89 -29.77 18.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 O-C-N 121.495 -0.753 . . . . 0.0 110.474 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -55.91 -31.68 63.1 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.873 -0.517 . . . . 0.0 110.268 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.82 -37.64 79.76 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -45.13 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -56.69 -39.12 73.25 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.753 178.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.4 m -63.33 -38.84 92.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.997 0.427 . . . . 0.0 110.144 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.447 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.2 OUTLIER -63.19 -41.98 99.28 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.254 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.741 HG13 HD21 ' C' ' 748' ' ' LEU . 98.8 t -61.69 -45.61 98.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.84 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.274 1.035 . . . . 0.0 111.055 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.413 ' HD2' ' C ' ' C' ' 707' ' ' ARG . 5.6 tmm_? -57.08 -51.06 70.79 Favored 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 121.301 -0.874 . . . . 0.0 110.654 -177.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -44.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -73.05 -44.19 61.03 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -103.28 -22.05 13.76 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.52 164.74 11.62 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' B' ' 704' ' ' LEU . 31.4 p90 -114.08 -47.62 2.94 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.474 0.654 . . . . 0.0 111.779 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 9.7 p -97.99 159.5 30.68 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 714' ' ' PRO . . . . . 0.429 ' HG3' ' HD2' ' B' ' 747' ' ' ARG . 27.3 Cg_exo -33.47 121.35 0.12 Allowed 'Trans proline' 0 N--CA 1.5 1.86 0 C-N-CA 122.19 1.927 . . . . 0.0 112.424 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.76 16.61 23.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 O-C-N 121.004 -1.06 . . . . 0.0 110.031 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 N--CA 1.467 0.419 0 CA-C-O 121.935 0.874 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 17.8 tpt85 -64.26 -30.73 71.77 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.333 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.75 -34.03 64.83 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.039 0.447 . . . . 0.0 111.05 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -58.1 -37.41 74.47 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.191 -0.318 . . . . 0.0 111.635 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -58.27 -39.28 78.81 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.461 -0.774 . . . . 0.0 108.975 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -36.46 71.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.376 177.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 54.2 p -61.7 -44.8 96.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.9 -0.5 . . . . 0.0 110.924 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.57 -28.67 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.286 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 4.9 mtm105 -59.81 -22.81 62.7 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.55 -0.719 . . . . 0.0 110.021 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.741 HD21 HG13 ' C' ' 705' ' ' VAL . 0.1 OUTLIER -67.11 -18.58 65.37 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.031 0.444 . . . . 0.0 110.18 178.427 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 46.4 t -55.74 -54.66 23.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.579 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -72.9 -21.07 60.97 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.338 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.86 -20.19 32.25 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.518 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.1 p -58.15 -37.62 74.99 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.909 -0.76 . . . . 0.0 109.103 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 13.6 tp -65.63 -51.32 60.48 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 754' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.01 -34.91 72.43 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.356 0.598 . . . . 0.0 111.854 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.476 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.5 tt -59.04 -45.34 90.98 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.0 0.429 . . . . 0.0 111.302 -177.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 50.9 mt -72.08 -37.28 59.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.509 0.671 . . . . 0.0 109.689 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.33 -31.42 69.85 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.78 -45.88 78.05 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.146 -0.971 . . . . 0.0 110.241 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 759' ' ' ASP . . . . . 0.721 ' O ' HD12 ' C' ' 763' ' ' LEU . 22.8 t70 -70.29 -42.86 71.5 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.427 0.632 . . . . 0.0 110.976 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.31 -36.81 83.88 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -82.41 -31.37 29.64 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 68.9 m -73.37 -45.84 52.62 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.538 -0.726 . . . . 0.0 112.751 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.77 HD13 ' H ' ' C' ' 764' ' ' SER . 0.0 OUTLIER -68.57 -39.0 81.2 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.689 -0.632 . . . . 0.0 112.61 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.77 ' H ' HD13 ' C' ' 763' ' ' LEU . 4.9 m -91.26 -34.27 15.03 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.832 -0.543 . . . . 0.0 111.53 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.06 60.88 1.43 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 122.304 1.05 . . . . 0.0 109.438 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.6 t80 60.53 160.53 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.327 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 50.4 m 55.69 -160.02 0.2 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -132.83 -34.39 1.14 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.371 -0.83 . . . . 0.0 110.463 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -53.5 -27.55 26.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.682 0.753 . . . . 0.0 109.888 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.48 -30.14 65.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.46 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.564 HD12 HD21 ' C' ' 763' ' ' LEU . 6.2 tt -59.66 -30.84 69.03 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.842 -0.536 . . . . 0.0 110.038 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -32.83 67.76 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.657 0.742 . . . . 0.0 109.2 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.33 -34.37 77.56 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.516 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.519 HD13 ' HA ' ' C' ' 763' ' ' LEU . 9.0 tp -57.88 -38.35 75.62 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 121.804 -0.56 . . . . 0.0 110.287 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 49.8 mt -58.44 -39.47 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.769 0.795 . . . . 0.0 109.814 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.56 -41.69 60.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.666 0.746 . . . . 0.0 110.691 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.13 -41.57 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.02 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.703 HG12 HG12 ' A' ' 746' ' ' ILE . 27.9 m -65.09 -39.69 86.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 O-C-N 121.514 -0.741 . . . . 0.0 110.766 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.759 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.0 OUTLIER -63.72 -45.19 91.07 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 122.041 -0.412 . . . . 0.0 111.489 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -31.63 71.62 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.552 HD13 ' HB ' ' A' ' 746' ' ' ILE . 61.4 mt -64.54 -39.44 85.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 119.051 -0.5 . . . . 0.0 112.157 -178.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.759 HG22 ' O ' ' C' ' 779' ' ' THR . 29.2 m -53.16 -37.95 29.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 CA-C-N 119.846 1.203 . . . . 0.0 110.126 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.01 -41.45 99.57 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.157 0.503 . . . . 0.0 111.446 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 41.3 tp -70.17 -44.51 68.64 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.653 HD22 ' HB3' ' A' ' 747' ' ' ARG . 0.8 OUTLIER -87.28 -15.8 37.02 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.599 1.091 . . . . 0.0 111.188 -179.472 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.28 -50.15 63.99 Favored Glycine 0 C--N 1.345 1.039 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 178.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 137.14 52.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.015 179.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.292 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.658 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.8 tp . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 61.4 mt 56.32 92.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.861 0.838 . . . . 0.0 110.927 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -164.58 178.14 7.57 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.054 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.464 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.9 tt -54.79 -43.93 73.28 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.579 0.704 . . . . 0.0 110.441 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.38 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -73.95 -45.46 50.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.197 0.522 . . . . 0.0 110.943 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -70.18 -46.34 64.81 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.803 0.335 . . . . 0.0 111.174 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.75 -28.38 68.99 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.022 0.439 . . . . 0.0 112.159 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.3 t -65.35 -36.84 85.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.367 0.603 . . . . 0.0 111.022 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.5 HD23 ' OG1' ' A' ' 676' ' ' THR . 0.7 OUTLIER -65.48 -23.65 66.96 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -59.62 -27.85 66.68 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.497 -0.752 . . . . 0.0 111.508 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -67.46 -24.03 65.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.883 -0.51 . . . . 0.0 111.625 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -54.96 -47.58 74.34 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.232 0.539 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 76.3 t80 60.77 7.49 1.46 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -118.01 -73.77 0.63 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.172 -0.955 . . . . 0.0 111.091 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.62 HG12 HD23 ' A' ' 679' ' ' LEU . 5.7 tt -68.06 -36.02 73.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 O-C-N 121.959 -0.463 . . . . 0.0 111.78 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.5 ' OG1' HD23 ' A' ' 669' ' ' LEU . 4.3 m -50.99 -33.58 25.35 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 122.033 -0.417 . . . . 0.0 111.351 -176.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.88 -49.2 75.79 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.544 0.688 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.545 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -65.51 -44.29 87.46 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 121.659 -0.651 . . . . 0.0 110.498 179.398 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.62 HD23 HG12 ' A' ' 675' ' ' ILE . 3.4 mm? -66.18 -39.36 89.66 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.2 t90 -89.27 -8.49 53.3 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -107.67 -8.5 16.1 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.551 -0.718 . . . . 0.0 111.833 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 678' ' ' TRP . 1.6 pt -60.53 -36.67 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 121.665 -0.647 . . . . 0.0 109.412 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.6 ttt-85 -53.45 -47.14 69.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 109.814 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.18 -36.09 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.451 ' O ' HG23 ' A' ' 689' ' ' VAL . 1.2 t80 -59.83 -28.59 67.61 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.485 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 14.1 mm -61.67 -51.98 66.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.358 0.599 . . . . 0.0 109.76 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.18 -36.46 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.728 0.775 . . . . 0.0 109.384 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -36.95 58.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.9 t -54.06 -40.07 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.21 -39.67 82.08 Favored Glycine 0 CA--C 1.532 1.119 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.28 -38.51 85.18 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.116 0.96 . . . . 0.0 109.596 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.64 -46.12 89.97 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.172 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.55 HG21 HG22 ' B' ' 693' ' ' ILE . 1.4 pp -68.15 -43.29 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 122.045 -0.41 . . . . 0.0 111.333 -177.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.68 -23.43 60.88 Favored Glycine 0 CA--C 1.54 1.596 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.31 -37.98 79.11 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.256 1.027 . . . . 0.0 108.957 178.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.674 ' HG3' HD11 ' C' ' 693' ' ' ILE . 15.5 mmt180 -55.99 -28.45 57.24 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.599 0.76 . . . . 0.0 112.541 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.36 -41.27 83.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.366 -0.833 . . . . 0.0 109.206 -177.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.755 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.51 -30.37 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.501 -0.75 . . . . 0.0 109.956 177.135 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.49 -28.56 55.31 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.255 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -37.01 71.3 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.9 m -58.83 -36.76 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 O-C-N 121.59 -0.694 . . . . 0.0 109.316 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -56.15 -38.22 70.55 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 19.4 m -64.06 -39.3 93.78 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-O 121.563 0.697 . . . . 0.0 109.922 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.503 HD22 ' NH1' ' A' ' 707' ' ' ARG . 0.5 OUTLIER -60.84 -44.72 96.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.571 1.176 . . . . 0.0 108.533 178.337 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.984 HG22 HD11 ' A' ' 748' ' ' LEU . 40.1 t -64.36 -42.86 96.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 114.411 -1.268 . . . . 0.0 109.128 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.59 -42.12 99.37 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.285 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.503 ' NH1' HD22 ' A' ' 704' ' ' LEU . 8.6 mtm105 -60.89 -45.8 93.17 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.138 0.971 . . . . 0.0 111.474 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.435 HG21 ' HA ' ' B' ' 713' ' ' SER . 3.0 t -75.89 -44.66 38.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.221 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -73.76 -14.69 61.16 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -90.82 -16.23 28.66 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.04 -1.037 . . . . 0.0 113.06 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.98 34.36 3.49 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 121.639 -0.663 . . . . 0.0 111.98 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 55.58 -136.03 1.27 Allowed 'General case' 0 CA--C 1.561 1.4 0 O-C-N 122.031 -0.688 . . . . 0.0 110.828 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 17.1 m -62.86 157.76 57.78 Favored Pre-proline 0 C--N 1.35 0.611 0 O-C-N 120.859 -1.151 . . . . 0.0 112.106 -178.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.433 ' HD2' HG21 ' C' ' 708' ' ' VAL . 73.0 Cg_exo -44.6 103.89 0.05 OUTLIER 'Trans proline' 0 N--CA 1.482 0.815 0 C-N-CA 121.763 1.642 . . . . 0.0 112.799 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.541 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.9 pt? -105.95 -20.61 13.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.564 0.697 . . . . 0.0 111.594 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.692 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 C-N-CA 123.378 0.671 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 14.0 ttm-85 -59.3 -26.73 65.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.481 -179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -9.06 0.65 Allowed 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.746 -0.596 . . . . 0.0 112.389 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.4 ttm105 -60.0 -41.73 92.72 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.411 -0.805 . . . . 0.0 109.48 179.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.593 ' HB3' HD12 ' C' ' 781' ' ' ILE . 0.9 OUTLIER -68.08 -41.11 82.38 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.534 0.683 . . . . 0.0 109.335 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -60.04 -46.83 88.23 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.279 -0.888 . . . . 0.0 108.955 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.8 p -69.15 -26.94 65.12 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.55 ' HB ' HG21 ' C' ' 781' ' ' ILE . 30.7 mt -74.89 -47.41 37.43 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-O 116.565 -1.683 . . . . 0.0 112.014 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.55 ' HB3' HD22 ' C' ' 785' ' ' LEU 0.343 14.1 ttt180 -73.45 -3.85 30.04 Favored 'General case' 0 C--N 1.361 1.109 0 CA-C-N 122.721 2.509 . . . . 0.0 111.47 -178.91 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.984 HD11 HG22 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -56.46 -15.4 4.14 Favored 'General case' 0 CA--C 1.577 1.992 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 169.601 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.425 HG12 ' OD1' ' A' ' 750' ' ' ASN 0.293 1.5 t -53.66 -54.2 20.81 Favored 'Isoleucine or valine' 0 C--N 1.363 1.182 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 175.172 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 750' ' ' ASN . . . . . 0.425 ' OD1' HG12 ' A' ' 749' ' ' VAL . 6.5 m120 -72.52 -22.43 61.03 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.158 -1.383 . . . . 0.0 108.686 175.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.87 -19.39 29.26 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.1 t -57.45 -37.11 72.3 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 51.6 tp -61.31 -49.25 77.76 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.0 -34.75 72.21 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.657 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.474 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.2 tt -58.67 -45.53 89.18 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.876 -0.515 . . . . 0.0 112.189 -176.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 40.3 mt -61.55 -32.24 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.24 -30.38 68.51 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.76 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.71 ' OD2' HD22 ' B' ' 715' ' ' LEU . 6.3 m-20 -55.51 -44.9 77.03 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.855 0.836 . . . . 0.0 109.248 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -70.41 -42.84 71.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.573 0.701 . . . . 0.0 111.372 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 22.6 mt -68.98 -29.85 68.14 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -79.16 -30.13 43.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.9 t -75.26 -45.02 42.71 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.951 0.881 . . . . 0.0 111.61 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.65 ' O ' HD22 ' A' ' 774' ' ' LEU . 0.5 OUTLIER -59.9 -53.59 56.06 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.232 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 3.3 m -97.9 -24.11 15.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.353 -0.842 . . . . 0.0 113.237 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.6 mt 66.55 -73.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.906 0.384 . . . . 0.0 109.989 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -135.8 133.76 38.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 109.516 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m 58.48 168.74 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.506 ' CE1' HD22 ' A' ' 771' ' ' LEU . 5.2 t80 -91.14 -17.56 25.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 120.963 0.411 . . . . 0.0 111.813 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.8 -34.0 77.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.004 0.907 . . . . 0.0 109.773 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -62.64 -29.53 70.7 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.003 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.529 HD11 HD23 ' A' ' 763' ' ' LEU . 40.2 tp -59.61 -45.52 91.68 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.891 -0.506 . . . . 0.0 111.928 -177.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 1.3 ptt85 -64.02 -33.74 76.43 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.708 -0.797 . . . . 0.0 109.45 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.33 -39.59 78.08 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.78 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.65 HD22 ' O ' ' A' ' 763' ' ' LEU . 1.8 tp -59.35 -38.49 80.52 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.971 -0.456 . . . . 0.0 111.2 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.11 -36.75 75.7 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 14.5 mt -67.86 -44.31 77.42 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.475 ' O ' HG13 ' A' ' 781' ' ' ILE . 6.0 pt -58.1 -36.5 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.409 HG22 HD11 ' B' ' 746' ' ' ILE . 91.7 t -53.54 -44.53 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 O-C-N 121.911 -0.493 . . . . 0.0 109.904 -177.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 51.7 p -63.79 -36.8 85.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.117 0.96 . . . . 0.0 109.649 177.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -34.11 76.55 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.832 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 777' ' ' ILE . 55.8 mt -68.76 -42.73 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.664 -0.647 . . . . 0.0 110.86 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.29 -38.55 82.43 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 O-C-N 121.467 -0.77 . . . . 0.0 110.343 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -42.86 91.98 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.713 0.768 . . . . 0.0 109.378 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.69 -37.06 85.42 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.496 0.665 . . . . 0.0 109.821 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp -65.27 -33.14 75.27 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.292 0.568 . . . . 0.0 110.251 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -37.67 -32.26 0.1 OUTLIER Glycine 0 CA--C 1.536 1.38 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.445 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -73.35 114.91 12.09 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 24.5 ttp-105 . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 117.774 -1.108 . . . . 0.0 110.481 -179.749 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.547 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.547 HD22 ' C ' ' B' ' 660' ' ' LEU . 1.1 mm? 55.61 102.35 0.01 OUTLIER 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.649 0.738 . . . . 0.0 110.392 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.71 176.27 2.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.546 0.689 . . . . 0.0 110.12 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.51 -42.84 61.99 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.465 0.65 . . . . 0.0 110.878 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.67 -36.69 73.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.02 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -71.2 -46.44 61.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.102 0.477 . . . . 0.0 110.864 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -67.46 -45.99 74.36 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.298 0.57 . . . . 0.0 110.89 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -20.14 66.14 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 30.8 t -67.88 -35.28 78.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.168 0.509 . . . . 0.0 110.986 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.1 mm? -59.86 -29.18 68.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.255 0.55 . . . . 0.0 111.304 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 44.7 m95 -60.3 -27.13 67.06 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 0.0 111.624 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -87.91 -10.3 51.04 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.998 -0.439 . . . . 0.0 112.18 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 10.4 m95 -74.55 -54.24 7.87 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.484 0.659 . . . . 0.0 111.015 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.15 27.77 17.28 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.286 0.565 . . . . 0.0 111.358 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -135.86 -78.69 0.42 Allowed 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.622 -0.673 . . . . 0.0 111.435 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.04 -36.87 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-O 121.64 0.733 . . . . 0.0 110.899 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -51.95 -33.18 36.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.357 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -55.96 -47.71 77.11 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.646 -0.659 . . . . 0.0 109.851 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.593 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.0 t90 -59.64 -38.13 80.56 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.879 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.523 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -58.46 -44.41 89.25 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.344 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -87.73 -42.15 12.82 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -65.76 -25.59 67.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.746 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.7 -36.64 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.774 -0.579 . . . . 0.0 110.887 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 683' ' ' ARG . . . . . 0.746 ' N ' HD12 ' B' ' 682' ' ' ILE . 4.3 ttt-85 -56.93 -47.18 81.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.165 0.507 . . . . 0.0 110.655 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.471 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.62 -34.45 65.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.553 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.82 -29.9 68.56 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.117 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.806 HD12 HG21 ' A' ' 686' ' ' ILE . 12.2 mm -60.85 -49.52 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.199 0.524 . . . . 0.0 109.995 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.26 -42.49 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 88.9 mt -58.79 -37.95 69.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 685' ' ' PHE . 56.0 t -64.75 -46.82 90.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.08 -27.0 9.58 Favored Glycine 0 CA--C 1.541 1.704 0 O-C-N 121.746 -0.596 . . . . 0.0 112.08 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.9 m -60.37 -43.55 96.44 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.557 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -32.23 70.2 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.513 -0.742 . . . . 0.0 112.361 -177.8 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.557 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.11 -44.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.589 -0.694 . . . . 0.0 109.288 -177.631 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.47 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.97 -32.74 81.15 Favored Glycine 0 CA--C 1.538 1.518 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.512 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -57.24 -37.57 72.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.522 0.677 . . . . 0.0 110.908 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 5.8 mmt180 -55.32 -28.93 56.92 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -59.36 -36.22 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 120.798 -1.189 . . . . 0.0 109.076 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.512 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -62.33 -30.36 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 O-C-N 121.691 -0.631 . . . . 0.0 110.157 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.3 m-85 -56.2 -30.32 62.12 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 121.737 -0.602 . . . . 0.0 109.5 179.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.4 -37.42 75.28 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 177.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 -39.51 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.03 -36.66 73.04 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.533 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 16.5 m -61.8 -35.38 78.02 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 122.055 -0.403 . . . . 0.0 110.917 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.42 -43.76 93.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.23 1.015 . . . . 0.0 108.361 178.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.526 HG22 HD22 ' B' ' 748' ' ' LEU . 53.3 t -64.93 -42.1 93.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.166 178.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.2 m-80 -62.19 -36.58 82.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.22 0.534 . . . . 0.0 110.856 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -68.63 -49.56 58.26 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 122.612 1.196 . . . . 0.0 110.509 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.37 -45.43 29.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -176.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -65.36 -45.94 82.16 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.437 -174.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 9.5 pt20 -105.92 -24.83 12.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.94 179.81 16.64 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -123.79 -63.84 1.19 Allowed 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.787 -0.831 . . . . 0.0 112.307 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 713' ' ' SER . . . . . 0.435 ' HA ' HG21 ' A' ' 708' ' ' VAL . 0.4 OUTLIER -63.78 159.29 54.9 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-O 118.562 -0.732 . . . . 0.0 109.738 179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -29.87 117.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.813 2.342 . . . . 0.0 112.703 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.71 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.3 tt -88.75 5.92 41.12 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 122.023 0.916 . . . . 0.0 110.139 179.762 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 122.104 0.954 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -66.03 -26.33 67.47 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.368 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -5.99 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 742' ' ' ARG . . . . . 0.539 ' HD3' HD21 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -55.08 -33.49 62.8 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.121 -0.987 . . . . 0.0 109.203 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -69.62 -34.03 73.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -47.75 70.03 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.335 178.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 745' ' ' SER . . . . . 0.477 ' O ' HD23 ' B' ' 748' ' ' LEU . 14.5 p -56.87 -34.71 68.1 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.463 HG21 ' CG2' ' A' ' 781' ' ' ILE . 0.3 OUTLIER -52.71 -23.71 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.766 178.138 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -21.63 59.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.526 HD22 HG22 ' B' ' 705' ' ' VAL . 4.0 pp -55.16 -23.52 21.9 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 121.274 0.559 . . . . 0.0 109.543 177.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 7.7 t -55.47 -53.98 30.3 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -72.64 -21.5 61.09 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.692 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.98 -20.6 34.65 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.745 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.6 -42.19 98.51 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 117.936 0.868 . . . . 0.0 109.801 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 15.7 tp -68.39 -47.31 67.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.977 0.894 . . . . 0.0 110.278 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -66.95 -34.19 77.22 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.784 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 755' ' ' LEU . . . . . 0.502 ' C ' HD13 ' B' ' 755' ' ' LEU . 2.5 tm? -58.6 -45.26 89.52 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.918 -0.489 . . . . 0.0 111.815 -176.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 756' ' ' ILE . . . . . 0.479 HG22 HD12 ' B' ' 760' ' ' LEU . 4.1 mp -72.08 -35.1 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.19 -30.8 69.08 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.66 ' CG ' HD22 ' C' ' 715' ' ' LEU . 10.6 m-20 -55.59 -45.4 77.42 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 120.734 -1.229 . . . . 0.0 109.271 -179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.67 -46.19 63.68 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 760' ' ' LEU . . . . . 0.479 HD12 HG22 ' B' ' 756' ' ' ILE . 44.9 mt -69.77 -46.24 66.24 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -49.97 75.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 762' ' ' SER . . . . . 0.418 ' O ' HD13 ' B' ' 774' ' ' LEU . 20.1 p -73.28 -38.33 65.96 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.635 0.731 . . . . 0.0 111.268 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.474 HD23 HD12 ' B' ' 771' ' ' LEU . 0.8 OUTLIER -65.61 -53.11 46.22 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 34.8 p -98.07 -49.13 4.87 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.516 -0.74 . . . . 0.0 112.041 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 765' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' B' ' 765' ' ' LEU . 0.3 OUTLIER 77.52 89.0 0.07 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 122.067 0.936 . . . . 0.0 111.337 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 62.62 -74.74 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.823 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 41.0 t -84.64 162.49 19.72 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.527 0.679 . . . . 0.0 111.747 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -23.18 18.01 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.631 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -67.7 -39.82 84.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 122.059 0.933 . . . . 0.0 109.004 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -58.83 -28.94 66.51 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.46 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 771' ' ' LEU . . . . . 0.474 HD12 HD23 ' B' ' 763' ' ' LEU . 2.6 tt -58.55 -30.72 67.34 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 9.3 mmt-85 -59.89 -32.88 71.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.64 -48.66 66.08 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.618 HD11 ' CZ ' ' C' ' 742' ' ' ARG . 0.4 OUTLIER -59.18 -37.8 78.27 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.3 1.048 . . . . 0.0 109.662 178.287 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -58.34 -36.37 73.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.445 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 66.1 mt -73.86 -31.71 63.31 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.615 -0.678 . . . . 0.0 112.236 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 777' ' ' ILE . . . . . 0.443 HD11 HH22 ' C' ' 742' ' ' ARG . 8.3 pt -70.35 -37.29 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.541 -0.725 . . . . 0.0 111.305 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.403 HG22 ' O ' ' B' ' 775' ' ' LEU . 35.5 m -66.08 -40.21 86.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.271 -0.893 . . . . 0.0 110.936 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.4 t -63.68 -47.41 81.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.803 -0.561 . . . . 0.0 112.081 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.7 82.1 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.699 -0.626 . . . . 0.0 111.695 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.418 HD12 ' O ' ' B' ' 777' ' ' ILE . 65.5 mt -63.97 -43.59 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 O-C-N 122.088 -0.383 . . . . 0.0 111.32 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.575 HG11 HG11 ' C' ' 749' ' ' VAL . 18.8 m -59.48 -38.24 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.48 -0.762 . . . . 0.0 109.8 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.32 -42.9 99.43 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.599 0.714 . . . . 0.0 109.674 179.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.62 -42.43 95.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.332 0.586 . . . . 0.0 110.832 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' C' ' 747' ' ' ARG . 10.9 tp -82.15 -14.58 55.47 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.041 0.448 . . . . 0.0 111.924 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -53.52 -44.2 67.45 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -75.32 141.67 43.35 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 122.296 -0.532 . . . . 0.0 109.977 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.851 -179.78 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.593 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 120.528 0.204 . . . . 0.0 110.798 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 18.4 mt 59.96 120.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.668 0.747 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -173.2 172.18 3.91 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.721 0.772 . . . . 0.0 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -57.53 -51.39 69.64 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 122.079 0.942 . . . . 0.0 109.448 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.54 ' N ' HD13 ' C' ' 663' ' ' LEU . 12.7 t70 -72.66 -16.64 61.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.759 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 tmtt? -81.08 -46.36 15.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.262 0.553 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -62.18 -46.34 89.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.241 0.543 . . . . 0.0 110.878 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.39 -22.09 66.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.982 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.7 -32.92 73.07 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.975 -0.453 . . . . 0.0 111.434 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.3 -34.16 77.5 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.194 0.521 . . . . 0.0 111.864 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.86 -26.77 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.983 0.421 . . . . 0.0 111.043 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -77.14 -31.75 55.85 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.942 0.401 . . . . 0.0 111.604 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.4 m0 -55.24 -42.65 73.71 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.542 0.687 . . . . 0.0 110.357 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 7.4 t80 55.49 34.58 23.34 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.218 0.532 . . . . 0.0 111.484 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -148.83 -73.7 0.18 Allowed 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.65 -0.656 . . . . 0.0 112.032 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.669 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -37.15 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.489 0.661 . . . . 0.0 111.599 -178.708 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -51.63 -33.54 33.8 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.91 -0.494 . . . . 0.0 111.383 -178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -57.29 -49.36 76.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.625 0.726 . . . . 0.0 109.64 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.521 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -64.56 -42.15 95.86 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.087 0.47 . . . . 0.0 110.062 179.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 32.2 mt -66.15 -35.64 81.01 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -99.56 -19.58 16.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -176.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -88.15 -18.17 29.35 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.428 -0.795 . . . . 0.0 112.281 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.522 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.0 pt -63.16 -37.58 79.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 O-C-N 121.945 -0.472 . . . . 0.0 111.786 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -57.18 -47.41 81.3 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.294 0.568 . . . . 0.0 110.044 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.494 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.0 mp -65.96 -32.17 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -61.13 -32.43 72.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.722 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 13.3 mm -61.97 -48.75 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 121.171 0.51 . . . . 0.0 110.158 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.96 -41.1 91.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 90.3 mt -59.91 -37.56 72.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.469 HG23 ' O ' ' C' ' 685' ' ' PHE . 42.6 t -54.7 -41.66 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.42 -42.07 74.0 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.91 -38.23 88.16 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.812 0.815 . . . . 0.0 109.302 177.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.37 -45.99 89.9 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.097 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.674 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -68.1 -41.09 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.662 179.804 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.541 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -32.48 78.83 Favored Glycine 0 CA--C 1.54 1.619 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.588 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.7 tt -55.0 -37.34 66.47 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.816 0.817 . . . . 0.0 110.742 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -55.49 -28.37 54.19 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.541 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.4 tt -58.36 -35.72 55.14 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.267 -0.896 . . . . 0.0 111.603 -175.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.588 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.8 p -54.26 -30.32 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 O-C-N 121.411 -0.806 . . . . 0.0 109.852 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -57.0 -31.83 65.49 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.525 -0.734 . . . . 0.0 110.52 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.22 95.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.243 1.021 . . . . 0.0 108.603 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.2 -38.74 78.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.926 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 tp -65.7 -40.04 91.88 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.183 0.593 . . . . 0.0 110.393 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -62.93 -31.99 73.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.044 0.45 . . . . 0.0 110.27 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.439 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.5 OUTLIER -63.22 -46.8 85.27 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 122.412 1.101 . . . . 0.0 108.428 177.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.514 HG13 HD13 ' C' ' 748' ' ' LEU . 84.6 t -63.12 -45.95 97.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.495 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -63.37 -36.58 84.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.128 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 15.2 ttp85 -60.24 -50.04 75.24 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 121.482 -0.761 . . . . 0.0 111.37 -176.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.522 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -77.67 -43.08 29.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -178.183 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.84 -44.73 92.31 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -175.057 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 710' ' ' GLN . . . . . 0.455 ' HB2' ' HB3' ' B' ' 758' ' ' ASP . 6.5 pt20 -103.92 -23.9 13.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.31 -177.3 16.44 Favored Glycine 0 CA--C 1.538 1.477 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -138.73 -43.66 0.48 Allowed 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.534 -0.98 . . . . 0.0 112.229 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.407 ' O ' ' C ' ' C' ' 714' ' ' PRO . 82.6 p -62.71 147.6 92.82 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 117.704 -1.141 . . . . 0.0 107.924 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 714' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' C' ' 713' ' ' SER . 44.8 Cg_exo -28.44 94.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.505 2.172 0 C-N-CA 122.962 2.442 . . . . 0.0 112.212 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.66 HD22 ' CG ' ' B' ' 758' ' ' ASP . 5.3 mp -69.84 -9.71 55.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.204 -1.362 . . . . 0.0 114.466 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 122.29 1.043 . . . . 0.0 112.386 -178.847 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 122.133 0.968 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 24.7 tpt85 -59.38 -26.99 65.58 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.898 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -34.51 70.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 111.955 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.618 ' CZ ' HD11 ' B' ' 774' ' ' LEU . 32.8 mtm105 -67.57 -27.84 67.28 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.97 -37.54 74.4 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.736 -0.603 . . . . 0.0 109.647 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.47 -43.2 67.04 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 121.502 0.668 . . . . 0.0 109.615 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -58.74 -38.12 77.7 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 121.895 -0.503 . . . . 0.0 110.914 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -56.75 -20.0 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 747' ' ' ARG . . . . . 0.417 ' HA ' HD22 ' B' ' 785' ' ' LEU . 70.8 mtp180 -59.57 -25.07 64.26 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.589 -0.694 . . . . 0.0 109.494 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.522 HD11 HG12 ' C' ' 708' ' ' VAL . 7.7 mt -55.92 -28.8 58.48 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 122.254 -0.279 . . . . 0.0 111.512 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 749' ' ' VAL . . . . . 0.575 HG11 HG11 ' B' ' 782' ' ' VAL . 85.2 t -55.43 -54.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.08 -26.91 61.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.331 1.062 . . . . 0.0 109.074 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.29 -20.9 38.15 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.054 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 47.8 m -58.74 -37.85 77.09 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.834 0.817 . . . . 0.0 109.379 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.53 -51.18 38.05 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.721 0.772 . . . . 0.0 109.994 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 754' ' ' ALA . . . . . 0.692 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.31 -34.58 78.0 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.414 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.0 tt -58.77 -45.45 89.77 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.768 -0.583 . . . . 0.0 110.785 -177.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 41.8 mm -69.88 -33.35 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 110.278 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.38 -31.14 69.35 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -55.81 -47.01 77.9 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.064 -1.022 . . . . 0.0 109.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.29 -45.36 66.47 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.991 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 27.3 mt -66.35 -45.45 80.15 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -66.43 -48.78 68.93 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.865 -0.522 . . . . 0.0 112.102 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.1 t -64.94 -45.29 86.4 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 110.759 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.449 ' O ' ' HG ' ' C' ' 774' ' ' LEU . 1.0 OUTLIER -68.34 -54.54 16.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.843 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.89 -47.48 5.54 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.124 -0.985 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 765' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' C' ' 766' ' ' PHE . 1.6 tt 72.84 129.91 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -178.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 766' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' C' ' 765' ' ' LEU . 32.9 t80 -9.05 123.53 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.902 1.281 . . . . 0.0 114.359 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 767' ' ' SER . . . . . 0.435 ' O ' ' C ' ' C' ' 768' ' ' TYR . 1.3 m 48.94 91.26 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.57 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 768' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' C' ' 770' ' ' ARG . 41.3 m-85 3.87 -97.86 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.691 1.197 . . . . 0.0 113.609 -179.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 39.59 -76.96 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.925 0.784 . . . . 0.0 113.103 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 770' ' ' ARG . . . . . 0.575 ' N ' ' O ' ' C' ' 768' ' ' TYR . 32.1 mmt180 -55.3 -29.01 57.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.465 0.706 . . . . 0.0 110.528 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.22 -38.15 79.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.671 -0.643 . . . . 0.0 109.452 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -38.82 72.94 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -69.32 -34.51 74.78 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.978 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.529 HD13 ' O ' ' C' ' 774' ' ' LEU . 3.5 tm? -58.4 -42.61 87.52 Favored 'General case' 0 C--N 1.355 0.813 0 O-C-N 121.759 -0.588 . . . . 0.0 109.606 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 8.3 mp -58.63 -43.05 89.57 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.921 -0.487 . . . . 0.0 111.181 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 9.9 mt -73.0 -33.24 65.65 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.107 0.479 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.542 ' O ' HG12 ' C' ' 781' ' ' ILE . 0.1 OUTLIER -62.35 -37.84 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.7 -42.72 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 122.151 -0.343 . . . . 0.0 110.9 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.772 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.6 p -63.36 -42.12 98.88 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.229 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -31.71 71.94 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 122.051 -0.405 . . . . 0.0 111.861 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.593 HD12 ' HB3' ' A' ' 743' ' ' ASP . 21.3 mm -56.23 -39.73 61.39 Favored 'Isoleucine or valine' 0 C--N 1.347 0.486 0 O-C-N 121.762 -0.586 . . . . 0.0 111.346 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.772 HG22 ' O ' ' C' ' 779' ' ' THR . 21.6 m -52.73 -37.44 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.464 -177.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -55.05 -41.65 71.71 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 784' ' ' LEU . . . . . 0.509 ' O ' HD12 ' C' ' 784' ' ' LEU . 2.2 tp -63.66 -45.03 92.01 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -176.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.55 HD22 ' HB3' ' A' ' 747' ' ' ARG . 0.6 OUTLIER -78.48 -31.99 48.1 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.577 0.703 . . . . 0.0 109.302 179.765 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.71 -38.24 7.46 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.756 -0.937 . . . . 0.0 110.756 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -95.95 139.14 32.58 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.457 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.684 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 120.762 0.315 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 175.32 129.78 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -171.65 177.81 3.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.923 0.868 . . . . 0.0 111.117 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.488 HD23 ' N ' ' A' ' 664' ' ' ASP . 5.1 tt -51.57 -51.1 58.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.721 0.772 . . . . 0.0 110.544 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 664' ' ' ASP . . . . . 0.488 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.3 t70 -64.9 -30.51 71.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.864 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -48.15 37.22 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.406 0.622 . . . . 0.0 110.815 -179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -62.81 -46.08 89.62 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.674 0.75 . . . . 0.0 110.33 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.77 -20.2 65.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.718 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 24.7 t -71.38 -32.07 68.04 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.156 0.503 . . . . 0.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.99 -34.62 73.57 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.897 0.379 . . . . 0.0 111.061 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -59.69 -16.44 26.75 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.842 -0.536 . . . . 0.0 111.313 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -82.63 -26.16 32.48 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.361 0.6 . . . . 0.0 110.732 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -60.31 -42.07 94.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.537 0.684 . . . . 0.0 110.299 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.5 t80 60.56 35.09 20.16 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.543 0.687 . . . . 0.0 111.267 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -156.09 -66.92 0.11 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.619 -0.675 . . . . 0.0 111.652 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -65.55 -37.37 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 O-C-N 121.891 -0.506 . . . . 0.0 111.342 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.48 -34.3 48.55 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.898 -0.501 . . . . 0.0 111.986 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -63.4 -50.53 69.47 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.326 0.584 . . . . 0.0 110.261 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.581 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.5 t90 -66.01 -44.12 85.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 122.167 0.984 . . . . 0.0 109.53 178.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -35.77 77.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.949 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -101.25 -50.53 3.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -59.9 -10.35 3.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.545 -0.722 . . . . 0.0 112.645 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.766 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.0 pp -60.71 -36.33 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 121.657 -0.652 . . . . 0.0 110.368 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.766 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.9 ttt-85 -54.63 -47.27 73.68 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.998 0.427 . . . . 0.0 110.403 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -69.38 -35.99 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.3 OUTLIER -59.96 -30.51 69.15 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.122 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.99 HD12 HG21 ' C' ' 686' ' ' ILE . 12.3 mm -60.58 -50.04 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.374 0.607 . . . . 0.0 109.629 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 79.2 mt -60.84 -39.02 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.1 -36.97 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.049 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.7 t -54.17 -40.04 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.237 -0.914 . . . . 0.0 108.554 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.43 -39.2 92.59 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -64.72 -38.21 90.22 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.666 0.746 . . . . 0.0 109.587 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -46.18 89.05 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.502 -178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -40.29 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.257 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.63 -28.42 67.8 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -61.98 -37.54 85.16 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.488 1.137 . . . . 0.0 109.035 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 29.7 mmt180 -55.73 -27.64 51.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.054 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 mm -58.19 -36.29 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 121.108 -0.995 . . . . 0.0 108.681 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.759 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -61.95 -30.29 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 O-C-N 121.534 -0.729 . . . . 0.0 110.572 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 6.4 m-85 -55.38 -29.07 57.76 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.865 -0.522 . . . . 0.0 110.54 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.14 -36.97 71.34 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.759 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.7 m -59.36 -36.2 62.62 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 CA-C-O 121.727 0.775 . . . . 0.0 108.967 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -60.89 -38.92 87.34 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.823 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 54.7 m -63.07 -38.86 92.89 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.762 0.792 . . . . 0.0 109.695 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.632 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.5 OUTLIER -61.4 -40.87 95.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 122.179 0.99 . . . . 0.0 109.312 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.798 HG22 HD12 ' A' ' 748' ' ' LEU . 95.8 t -68.56 -43.59 83.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.065 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -62.31 -41.79 98.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.409 ' HA ' HD21 ' C' ' 704' ' ' LEU . 15.1 ptp180 -66.05 -38.74 89.11 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 121.012 -1.055 . . . . 0.0 111.498 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.35 -43.96 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.955 0.883 . . . . 0.0 108.893 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -73.77 -15.73 61.19 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -87.97 -20.87 25.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.279 -0.888 . . . . 0.0 111.992 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.94 37.99 2.09 Favored Glycine 0 CA--C 1.54 1.638 0 O-C-N 121.6 -0.687 . . . . 0.0 113.094 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' NH1' ' C' ' 707' ' ' ARG . 0.6 OUTLIER 49.17 -133.49 1.5 Allowed 'General case' 0 CA--C 1.566 1.576 0 O-C-N 121.616 -0.932 . . . . 0.0 110.077 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.569 ' HA ' HG21 ' C' ' 708' ' ' VAL . 6.7 p -62.92 159.9 42.17 Favored Pre-proline 0 C--N 1.354 0.784 0 O-C-N 120.925 -1.11 . . . . 0.0 109.138 178.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 714' ' ' PRO . . . . . 0.421 ' HG3' HD12 ' C' ' 748' ' ' LEU . 35.7 Cg_exo -36.81 119.76 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.144 1.896 . . . . 0.0 112.877 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.449 HD23 ' N ' ' A' ' 716' ' ' SER . 0.1 OUTLIER -109.35 -20.54 12.89 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.449 ' N ' HD23 ' A' ' 715' ' ' LEU . 1.4 t . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 122.482 1.134 . . . . 0.0 110.589 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 CA--C 1.536 0.437 0 CA-C-O 121.698 0.761 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -58.04 -26.56 62.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.385 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.27 -37.01 74.13 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.695 -0.628 . . . . 0.0 112.133 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 742' ' ' ARG . . . . . 0.506 ' HD3' ' HB2' ' C' ' 762' ' ' SER . 0.1 OUTLIER -59.2 -46.39 88.54 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.777 -0.577 . . . . 0.0 112.363 -179.051 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 743' ' ' ASP . . . . . 0.791 ' HA ' HD11 ' C' ' 781' ' ' ILE . 1.4 p30 -59.46 -44.77 92.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.577 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 744' ' ' ARG . . . . . 0.599 ' HD3' HD12 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -71.15 -34.84 71.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.931 179.244 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 9.2 p -59.82 -42.52 93.68 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 122.113 -0.367 . . . . 0.0 111.438 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.878 HG22 HG21 ' C' ' 781' ' ' ILE . 21.9 mt -65.63 -46.64 88.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-O 116.771 -1.585 . . . . 0.0 113.66 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.876 ' HB3' ' HB3' ' C' ' 785' ' ' LEU . 0.1 OUTLIER -67.59 -5.0 13.42 Favored 'General case' 0 C--N 1.351 0.663 0 CA-C-N 122.204 2.275 . . . . 0.0 109.989 -178.862 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.798 HD12 HG22 ' A' ' 705' ' ' VAL . 2.8 tm? -54.9 -15.13 1.76 Allowed 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.452 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.304 1.3 t -53.1 -53.95 19.77 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 175.087 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -72.39 -30.22 64.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 113.999 -1.455 . . . . 0.0 107.727 174.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.499 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.36 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 96.0 p -57.28 -36.87 71.57 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.3 -49.21 77.93 Favored 'General case' 0 C--N 1.346 0.457 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 176.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.0 73.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.735 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -59.21 -42.58 91.28 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.857 -0.527 . . . . 0.0 111.239 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 66.1 mt -61.61 -35.68 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.96 -30.61 69.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.199 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.511 ' HB3' HD13 ' B' ' 715' ' ' LEU . 7.1 m-20 -55.7 -49.22 73.59 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.566 -0.709 . . . . 0.0 109.58 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.75 -43.73 68.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.873 0.844 . . . . 0.0 110.388 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 760' ' ' LEU . . . . . 0.4 ' HA ' HD11 ' A' ' 763' ' ' LEU . 0.3 OUTLIER -59.74 -32.39 70.51 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.924 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -82.27 -31.14 30.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -177.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 35.8 t -66.46 -46.61 75.81 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.397 -0.814 . . . . 0.0 112.766 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -69.37 -55.05 11.52 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 121.661 -0.649 . . . . 0.0 112.406 -179.589 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 4.5 p -98.26 -49.13 4.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.685 0.755 . . . . 0.0 112.959 -177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.483 HD12 ' HG2' ' B' ' 739' ' ' GLU . 0.6 OUTLIER 83.76 -70.26 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.663 0.785 . . . . 0.0 110.636 -177.91 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -128.72 -58.25 1.17 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.792 -0.568 . . . . 0.0 111.051 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.4 m -92.2 132.15 36.87 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.081 0.467 . . . . 0.0 110.126 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CZ ' HD22 ' A' ' 771' ' ' LEU . 1.7 t80 -61.77 -13.0 19.67 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.121 -0.362 . . . . 0.0 111.413 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -37.56 87.99 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.926 0.87 . . . . 0.0 108.995 178.032 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -29.27 59.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.578 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 763' ' ' LEU . 24.4 tp -58.97 -39.44 81.73 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 41.5 mtp180 -66.93 -32.96 74.56 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.54 -45.68 74.99 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.679 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' HG23 ' A' ' 778' ' ' VAL . 5.7 tp -58.97 -42.29 89.58 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.136 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 775' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 775' ' ' LEU . 1.1 tt -63.38 -38.53 91.51 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.689 -0.632 . . . . 0.0 111.005 -177.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.75 -43.96 57.57 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 121.944 -0.473 . . . . 0.0 112.013 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 777' ' ' ILE . . . . . 0.415 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.6 pp -68.68 -37.45 77.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.048 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 774' ' ' LEU . 41.1 t -56.29 -46.17 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 121.791 -0.568 . . . . 0.0 109.706 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 779' ' ' THR . . . . . 0.738 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.8 p -63.52 -46.01 88.01 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.835 -0.541 . . . . 0.0 112.067 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -31.79 72.37 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.471 ' HB ' HG21 ' B' ' 746' ' ' ILE . 56.4 mt -54.77 -36.41 36.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.583 -0.698 . . . . 0.0 110.55 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 779' ' ' THR . 13.1 m -54.2 -38.39 38.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 121.23 -0.919 . . . . 0.0 109.753 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.34 -49.22 78.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.626 0.726 . . . . 0.0 110.774 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 31.3 tp -70.01 -42.48 72.94 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.264 0.554 . . . . 0.0 111.92 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.513 HD11 ' HG3' ' B' ' 747' ' ' ARG . 0.2 OUTLIER -75.32 -17.95 60.13 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.021 0.439 . . . . 0.0 111.703 -179.199 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.09 -41.76 11.45 Favored Glycine 0 CA--C 1.533 1.162 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -110.13 151.87 26.72 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 122.062 -0.669 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 8.8 tpp85 . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 118.1 -0.952 . . . . 0.0 110.327 -179.599 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.452 ' C ' HD22 ' B' ' 661' ' ' LEU . 4.0 mp . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.57 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.0 mm? 61.77 115.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.524 0.678 . . . . 0.0 110.327 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -179.72 170.99 1.23 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.467 HD11 ' HB2' ' C' ' 660' ' ' LEU . 32.8 tp -64.22 -40.75 96.7 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 121.473 0.654 . . . . 0.0 110.498 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.13 -24.15 67.76 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.379 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -81.26 -43.21 19.53 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -62.02 -46.79 87.64 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 122.006 0.908 . . . . 0.0 110.607 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.22 65.45 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.618 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 7.1 t -72.31 -29.22 63.65 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.819 0.342 . . . . 0.0 111.389 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.562 HD12 HG23 ' B' ' 675' ' ' ILE . 3.8 mm? -59.91 -32.73 71.03 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 122.185 -0.322 . . . . 0.0 111.179 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -59.66 -20.38 55.76 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.769 -0.582 . . . . 0.0 111.197 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -88.0 -20.41 25.87 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.169 0.509 . . . . 0.0 111.341 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -72.55 -46.7 53.18 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.099 0.476 . . . . 0.0 111.127 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 67.7 t80 58.66 19.86 7.19 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.379 0.609 . . . . 0.0 111.314 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -130.53 -67.72 0.72 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 121.378 -0.826 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.562 HG23 HD12 ' B' ' 669' ' ' LEU . 6.4 tp -68.27 -37.11 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.891 0.377 . . . . 0.0 110.92 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.15 -33.92 42.42 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.232 -0.293 . . . . 0.0 111.775 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -63.79 -50.35 69.35 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 109.883 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.652 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.97 -43.08 88.94 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 121.751 0.786 . . . . 0.0 109.754 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -35.75 82.1 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 8.9 t90 -103.93 -26.68 12.56 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -82.24 -10.48 59.11 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.513 -0.742 . . . . 0.0 111.761 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.652 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -60.85 -36.33 70.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.824 -0.548 . . . . 0.0 110.793 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.5 ttt-85 -53.32 -47.39 69.33 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.925 0.393 . . . . 0.0 110.4 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.461 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -66.7 -35.58 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.528 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.03 -29.46 68.52 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.18 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.696 HD12 HG21 ' A' ' 686' ' ' ILE . 17.6 mm -60.79 -48.28 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.211 0.529 . . . . 0.0 110.277 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.44 -43.17 94.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 89.4 mt -58.85 -37.71 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 685' ' ' PHE . 46.6 t -62.2 -48.77 86.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.5 -27.1 11.12 Favored Glycine 0 CA--C 1.54 1.613 0 O-C-N 121.772 -0.58 . . . . 0.0 111.896 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.0 m -60.61 -39.68 89.07 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.494 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.62 -32.7 70.66 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.235 -0.916 . . . . 0.0 111.643 -177.619 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.494 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.87 -46.96 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.883 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.45 -27.39 67.78 Favored Glycine 0 CA--C 1.542 1.737 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 178.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -37.16 67.37 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.758 0.789 . . . . 0.0 110.458 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 15.9 mmt180 -55.18 -27.99 49.78 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.726 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.29 -36.44 58.1 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 O-C-N 120.792 -1.193 . . . . 0.0 109.465 -177.074 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.0 p -66.99 -30.25 48.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.477 -0.764 . . . . 0.0 110.169 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.6 m-85 -55.88 -30.58 61.77 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.648 -0.657 . . . . 0.0 109.652 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.57 76.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -41.98 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 176.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.08 -37.87 72.51 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.445 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 29.2 m -62.83 -37.0 85.04 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.289 0.566 . . . . 0.0 110.38 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -45.26 93.29 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 122.322 1.058 . . . . 0.0 109.137 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.8 -43.34 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.995 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.36 -36.42 82.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.568 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -63.58 -49.56 72.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 122.404 1.097 . . . . 0.0 110.764 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD21 ' B' ' 748' ' ' LEU . 1.5 t -77.16 -44.9 30.81 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 114.79 -1.095 . . . . 0.0 113.645 -177.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.25 -45.94 92.43 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.639 ' O ' HD12 ' B' ' 715' ' ' LEU . 5.1 pt20 -105.77 -24.69 12.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.415 1.102 . . . . 0.0 113.644 178.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 129.63 136.34 4.05 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 712' ' ' TYR . . . . . 0.632 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.8 p90 -73.71 -61.77 1.72 Allowed 'General case' 0 N--CA 1.477 0.913 0 O-C-N 122.002 -0.705 . . . . 0.0 112.072 -178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 54.9 p -66.35 159.36 73.0 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.632 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.51 ' HB3' HD23 ' A' ' 748' ' ' LEU . 41.7 Cg_exo -32.5 131.78 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.31 2.007 . . . . 0.0 112.825 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.639 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.6 tt -93.74 -20.42 20.15 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -176.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 716' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 715' ' ' LEU . 2.8 t . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 122.17 0.986 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 739' ' ' GLU . . . . . 0.483 ' HG2' HD12 ' A' ' 765' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 18.4 tpt85 -65.94 -26.98 67.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.575 0.703 . . . . 0.0 111.275 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -60.83 -6.7 1.9 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -55.73 -39.63 71.39 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.517 -0.739 . . . . 0.0 111.195 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -58.02 -39.69 78.97 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.655 -0.653 . . . . 0.0 109.74 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -68.01 -38.85 83.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 745' ' ' SER . . . . . 0.458 ' O ' HD23 ' B' ' 748' ' ' LEU . 1.3 p -59.7 -44.68 93.57 Favored 'General case' 0 N--CA 1.462 0.175 0 O-C-N 121.963 -0.461 . . . . 0.0 110.564 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.51 HD11 HG22 ' A' ' 778' ' ' VAL . 1.2 mp -55.17 -19.45 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.418 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.513 ' HG3' HD11 ' A' ' 785' ' ' LEU . 1.3 ttt85 -59.89 -26.63 66.04 Favored 'General case' 0 C--N 1.346 0.428 0 O-C-N 121.594 -0.691 . . . . 0.0 109.437 178.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.664 HD21 HG11 ' B' ' 708' ' ' VAL . 3.2 mm? -55.49 -20.4 12.7 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 749' ' ' VAL . . . . . 0.414 HG23 ' O ' ' B' ' 746' ' ' ILE . 65.2 t -57.43 -54.22 33.84 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 176.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -72.94 -18.0 61.43 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.211 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.06 -20.68 35.56 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.915 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 23.1 p -58.76 -38.05 77.6 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.031 0.916 . . . . 0.0 109.685 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.91 -49.98 58.83 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.243 0.544 . . . . 0.0 110.029 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.52 78.61 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.98 -45.53 88.64 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.582 -0.699 . . . . 0.0 111.604 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 55.9 mt -67.01 -38.59 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 121.835 0.826 . . . . 0.0 109.484 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.01 67.96 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.587 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -55.15 -49.35 72.03 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.734 -1.229 . . . . 0.0 110.05 -178.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.25 -46.36 61.18 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.18 -46.83 63.81 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -63.85 -37.82 88.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.37 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 84.5 p -70.44 -45.17 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.52 0.676 . . . . 0.0 110.957 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.678 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.7 OUTLIER -61.92 -53.7 52.13 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.926 0.714 . . . . 0.0 112.926 -178.517 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.6 p -98.5 -11.82 21.89 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -177.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.41 -154.62 0.34 Allowed 'General case' 0 CA--C 1.552 1.023 0 O-C-N 121.206 -0.934 . . . . 0.0 108.54 -177.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -48.93 -72.61 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.36 -0.837 . . . . 0.0 111.529 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 87.6 p -80.34 177.2 9.13 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.707 -0.621 . . . . 0.0 111.334 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.42 -31.98 13.13 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.978 -0.451 . . . . 0.0 110.722 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -53.89 -35.18 61.32 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.522 0.677 . . . . 0.0 109.854 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -29.57 60.33 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.66 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -59.44 -35.45 74.04 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 121.934 -0.479 . . . . 0.0 110.103 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -39.24 90.63 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -69.18 -45.18 70.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.337 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.678 HD13 ' O ' ' B' ' 763' ' ' LEU . 1.0 OUTLIER -63.05 -37.9 89.04 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.958 0.885 . . . . 0.0 110.564 179.721 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.537 HD13 ' O ' ' B' ' 775' ' ' LEU . 3.5 tm? -58.75 -36.66 74.72 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.381 0.61 . . . . 0.0 110.539 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.27 -35.61 73.86 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.59 -0.694 . . . . 0.0 112.152 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 21.7 pt -70.29 -37.09 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 O-C-N 121.688 -0.632 . . . . 0.0 111.325 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.513 HG12 HG12 ' C' ' 746' ' ' ILE . 3.4 m -61.9 -39.48 83.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 121.132 -0.98 . . . . 0.0 109.857 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 20.4 p -63.69 -47.32 81.66 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.929 -0.482 . . . . 0.0 112.2 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -33.25 74.15 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.405 -0.809 . . . . 0.0 111.269 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 71.0 mt -66.12 -44.57 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.8 -0.563 . . . . 0.0 111.834 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.603 HG11 HG11 ' C' ' 749' ' ' VAL . 24.8 m -59.3 -38.1 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.471 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -57.41 -44.25 84.43 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.798 0.809 . . . . 0.0 109.82 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 25.6 tp -69.98 -43.46 71.44 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.871 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' C' ' 750' ' ' ASN . 8.2 tp -65.03 -25.23 67.75 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.964 -0.46 . . . . 0.0 111.15 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -36.17 -47.96 1.1 Allowed Glycine 0 CA--C 1.536 1.363 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.75 97.44 8.08 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.686 -179.076 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.5 ' O ' HD12 ' C' ' 660' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 121.576 0.703 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.32 160.28 15.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.093 0.473 . . . . 0.0 110.818 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 172.81 175.56 0.1 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.29 0.567 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.699 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -58.07 -45.95 86.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.85 0.834 . . . . 0.0 109.622 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.654 ' N ' HD13 ' C' ' 663' ' ' LEU . 10.0 t70 -73.3 -22.7 60.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.149 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -46.51 14.58 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.1 0.476 . . . . 0.0 111.145 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -58.8 -46.15 88.26 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.406 0.622 . . . . 0.0 109.602 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.75 -21.04 65.29 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.971 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.1 t -64.86 -35.12 80.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.987 0.423 . . . . 0.0 111.523 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.68 -36.28 76.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.132 0.491 . . . . 0.0 110.98 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -59.55 -22.15 61.29 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.3 0.571 . . . . 0.0 110.768 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -75.93 -29.26 58.29 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.457 0.646 . . . . 0.0 110.736 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -61.52 -41.66 97.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.749 0.785 . . . . 0.0 109.892 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 5.7 t80 58.87 36.03 24.46 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.027 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -160.98 -68.08 0.06 Allowed 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.571 -0.706 . . . . 0.0 112.291 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.635 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -62.91 -37.22 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-O 121.472 0.653 . . . . 0.0 111.415 -178.689 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -52.41 -33.67 44.81 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 122.014 -0.429 . . . . 0.0 111.444 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -56.83 -49.25 75.98 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.63 0.729 . . . . 0.0 109.745 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.559 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.2 t90 -65.14 -40.62 94.67 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.908 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.69 -35.89 82.07 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -92.86 -48.39 6.57 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -60.34 -21.16 61.74 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.902 -0.499 . . . . 0.0 112.086 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.1 pp -60.48 -36.5 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 O-C-N 121.713 -0.617 . . . . 0.0 110.547 179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -57.65 -47.14 83.09 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.244 0.545 . . . . 0.0 110.257 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.471 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -70.95 -33.25 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 121.67 0.747 . . . . 0.0 109.067 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.452 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.62 -33.99 72.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.037 -179.309 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.99 HG21 HD12 ' A' ' 686' ' ' ILE . 13.0 mm -60.65 -43.48 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.45 0.643 . . . . 0.0 109.498 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -66.01 -41.65 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.25 -38.0 72.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.452 HG23 ' O ' ' C' ' 685' ' ' PHE . 69.3 t -54.99 -40.42 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.08 -37.82 87.27 Favored Glycine 0 CA--C 1.531 1.058 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -67.29 -37.72 83.86 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.063 0.935 . . . . 0.0 109.465 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.24 -44.55 92.35 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.024 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -62.68 -42.05 94.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 121.242 0.544 . . . . 0.0 109.778 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.62 -33.08 80.65 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.507 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.8 tt -60.82 -37.93 83.68 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.971 0.891 . . . . 0.0 109.839 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -56.09 -28.3 57.14 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.6 tt -58.44 -36.02 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.258 -0.901 . . . . 0.0 111.206 -175.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.507 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.5 p -54.43 -30.18 21.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 121.425 -0.797 . . . . 0.0 110.219 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -56.39 -31.3 63.72 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.822 -0.549 . . . . 0.0 110.293 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.65 82.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -68.72 -42.52 83.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.82 -38.14 84.4 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.496 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.0 m -66.76 -37.12 83.99 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.424 0.631 . . . . 0.0 110.088 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -63.73 -42.32 97.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.954 0.883 . . . . 0.0 108.821 178.444 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.659 HG13 HD21 ' C' ' 748' ' ' LEU . 41.0 t -65.08 -45.54 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 122.546 1.165 . . . . 0.0 108.716 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.85 -35.89 81.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.015 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.412 ' NH1' ' CZ ' ' A' ' 712' ' ' TYR . 0.0 OUTLIER -62.56 -49.58 74.72 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 121.685 -0.635 . . . . 0.0 111.336 -177.11 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.569 HG21 ' HA ' ' A' ' 713' ' ' SER . 3.0 p -77.47 -44.41 29.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.527 0.68 . . . . 0.0 112.331 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 709' ' ' ARG . . . . . 0.455 ' HB2' HD22 ' C' ' 748' ' ' LEU . 2.3 tmm_? -73.97 -33.11 63.74 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -101.56 -17.68 16.27 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 113.048 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.84 169.87 14.91 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -120.96 -48.56 2.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.217 -0.578 . . . . 0.0 110.962 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 25.7 p -106.69 157.98 33.86 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.615 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 714' ' ' PRO . . . . . 0.402 ' HG3' HD22 ' B' ' 748' ' ' LEU . 51.1 Cg_exo -38.14 96.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.803 0 C-N-CA 121.913 1.742 . . . . 0.0 111.912 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' C' ' 716' ' ' SER . 28.1 tp -73.41 -20.68 60.67 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.001 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 716' ' ' SER . . . . . 0.469 ' C ' ' O ' ' C' ' 715' ' ' LEU . 3.2 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.079 0.943 . . . . 0.0 113.04 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.908 0.861 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 tpt85 -71.86 -26.85 62.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.563 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -38.92 84.91 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.24 0.543 . . . . 0.0 110.803 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.774 ' O ' HD12 ' C' ' 746' ' ' ILE . 28.0 mtm105 -62.5 -36.39 82.39 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.102 -0.374 . . . . 0.0 111.319 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -58.46 -39.93 81.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.484 . . . . 0.0 110.102 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.59 -49.33 41.49 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.137 0.494 . . . . 0.0 110.798 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -33.83 67.04 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.012 -0.43 . . . . 0.0 110.699 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.774 HD12 ' O ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -59.23 -24.43 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 O-C-N 121.469 -0.769 . . . . 0.0 109.095 178.264 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -59.37 -21.49 59.94 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.659 HD21 HG13 ' C' ' 705' ' ' VAL . 9.3 tp -55.62 -27.21 48.31 Favored 'General case' 0 C--N 1.348 0.519 0 O-C-N 122.128 -0.358 . . . . 0.0 110.748 178.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 749' ' ' VAL . . . . . 0.603 HG11 HG11 ' B' ' 782' ' ' VAL . 90.0 t -55.52 -54.08 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.443 ' HB2' HD23 ' B' ' 785' ' ' LEU . 7.9 m120 -72.42 -25.8 61.62 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.33 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.59 -20.96 40.67 Favored Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.705 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.0 m -59.98 -37.95 81.11 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.752 -0.852 . . . . 0.0 109.386 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.6 tp -66.7 -51.2 58.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.418 0.628 . . . . 0.0 109.889 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.0 79.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.584 0.707 . . . . 0.0 111.365 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 755' ' ' LEU . . . . . 0.52 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.1 tt -59.4 -45.45 91.46 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 -178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.25 -35.04 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.64 0.733 . . . . 0.0 109.325 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.14 68.1 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.471 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -55.36 -46.61 76.46 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.069 -1.019 . . . . 0.0 109.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.69 -45.48 64.93 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.15 -44.0 73.19 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 761' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' C' ' 765' ' ' LEU . 10.3 mtm180 -61.39 -49.8 75.46 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 762' ' ' SER . . . . . 0.506 ' HB2' ' HD3' ' A' ' 742' ' ' ARG . 1.7 p -66.15 -45.31 81.41 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.542 -0.724 . . . . 0.0 110.8 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.516 ' HA ' ' HG ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -59.72 -54.38 47.08 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 -178.408 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.86 -48.72 4.81 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 765' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' C' ' 761' ' ' ARG . 0.3 OUTLIER 85.97 -78.61 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -177.642 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -124.59 -86.89 0.63 Allowed 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.483 -0.761 . . . . 0.0 111.337 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 83.4 p -90.13 167.28 12.85 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.56 -0.713 . . . . 0.0 110.225 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.12 -16.18 63.6 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.949 0.404 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -71.12 -44.03 66.42 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -62.69 -30.65 71.55 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.335 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.431 ' C ' HD23 ' C' ' 771' ' ' LEU . 5.3 tt -60.54 -30.49 69.79 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.828 -0.545 . . . . 0.0 109.86 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -57.25 -38.44 73.83 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.167 -0.333 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.29 -39.2 93.9 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.739 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.722 HD22 HD12 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -67.39 -38.17 84.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 121.772 0.796 . . . . 0.0 109.872 178.498 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.724 ' O ' HG22 ' C' ' 778' ' ' VAL . 2.7 mm? -58.42 -36.27 73.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.81 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -70.56 -29.68 66.2 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.536 -0.727 . . . . 0.0 110.405 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 777' ' ' ILE . . . . . 0.722 HD12 HD22 ' C' ' 774' ' ' LEU . 48.2 mt -60.77 -39.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.346 0.415 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.153 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.724 HG22 ' O ' ' C' ' 775' ' ' LEU . 15.0 m -55.5 -43.83 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 119.067 0.849 . . . . 0.0 113.013 -175.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.534 ' O ' HG22 ' C' ' 782' ' ' VAL . 2.4 p -64.28 -48.21 76.56 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.107 -0.995 . . . . 0.0 111.615 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -29.13 68.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.878 HG21 HG22 ' A' ' 746' ' ' ILE . 0.1 OUTLIER -52.98 -36.55 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.6 -175.534 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.534 HG22 ' O ' ' C' ' 779' ' ' THR . 34.5 m -53.41 -37.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 119.11 -1.036 . . . . 0.0 112.092 -177.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.83 -41.91 87.98 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 6.8 tp -70.67 -45.39 65.16 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 -175.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.876 ' HB3' ' HB3' ' A' ' 747' ' ' ARG . 0.5 OUTLIER -88.2 -17.35 31.03 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 120.625 1.557 . . . . 0.0 112.313 -177.427 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 786' ' ' GLY . . . . . 0.471 ' HA2' ' CZ ' ' A' ' 747' ' ' ARG . . . -52.91 -26.66 27.13 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 177.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.57 131.74 52.58 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.218 -0.578 0 CA-C-O 118.114 -0.946 . . . . 0.0 110.326 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.732 ' N ' HD23 ' C' ' 663' ' ' LEU . 6.8 tp . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 48.2 mt 56.82 90.08 0.04 OUTLIER 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.994 0.902 . . . . 0.0 110.267 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -161.7 -177.34 5.82 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.519 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.486 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.5 OUTLIER -52.31 -40.68 62.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.201 0.525 . . . . 0.0 110.512 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -36.02 65.92 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -178.476 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -43.54 56.95 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.387 0.613 . . . . 0.0 111.075 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -74.0 -45.83 47.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.406 -179.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.52 -35.86 82.13 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.137 0.494 . . . . 0.0 111.337 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -32.79 68.48 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.319 0.58 . . . . 0.0 110.886 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -24.1 67.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.828 0.347 . . . . 0.0 111.487 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -67.95 -19.57 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.003 -0.436 . . . . 0.0 111.688 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -80.88 -17.81 49.36 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.046 0.45 . . . . 0.0 111.508 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.72 -47.98 82.8 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.2 48.01 3.87 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 112.181 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.81 -71.48 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.651 -0.655 . . . . 0.0 112.235 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.657 HG13 HD23 ' A' ' 679' ' ' LEU . 7.2 tp -66.83 -36.81 78.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 O-C-N 121.804 -0.56 . . . . 0.0 112.054 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.7 m -51.75 -33.21 33.97 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.922 -0.486 . . . . 0.0 112.037 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.38 -49.55 77.37 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.564 -0.71 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -65.78 -44.8 84.7 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.545 0.688 . . . . 0.0 110.583 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.657 HD23 HG13 ' A' ' 675' ' ' ILE . 4.5 mm? -66.64 -37.43 84.81 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -89.91 -1.93 58.08 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -119.96 0.18 10.74 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.431 0.634 . . . . 0.0 110.619 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 685' ' ' PHE . 2.4 tp -61.66 -36.36 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-O 122.115 0.96 . . . . 0.0 110.112 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -59.39 -44.89 92.72 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.78 -33.66 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -59.66 -33.48 71.6 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.804 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.995 HG21 HD12 ' B' ' 686' ' ' ILE . 8.4 mm -60.69 -42.42 91.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.166 0.508 . . . . 0.0 109.9 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -71.82 -39.56 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.4 mt -61.94 -40.69 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.971 -0.455 . . . . 0.0 110.6 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 685' ' ' PHE . 63.0 t -54.49 -39.46 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.14 -36.54 82.56 Favored Glycine 0 CA--C 1.537 1.456 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.8 m -65.02 -38.16 89.99 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.816 0.817 . . . . 0.0 109.455 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.05 -46.39 88.36 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.704 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.787 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -68.48 -39.89 81.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.596 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.92 -20.74 54.1 Favored Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.219 -0.925 . . . . 0.0 111.014 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -36.68 82.47 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 122.128 0.965 . . . . 0.0 110.151 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 24.9 mmt180 -56.3 -30.18 62.18 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 1.4 pp -60.5 -36.64 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.542 -1.349 . . . . 0.0 108.893 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.81 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.3 t -67.16 -30.24 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 CA-C-N 115.357 -0.838 . . . . 0.0 108.933 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.2 OUTLIER -55.64 -27.92 52.45 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 122.871 0.468 . . . . 0.0 110.343 178.6 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.44 -36.97 69.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.81 HG22 ' O ' ' A' ' 698' ' ' VAL . 11.4 m -59.1 -35.69 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -42.6 91.35 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 703' ' ' SER . . . . . 0.434 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 7.2 m -66.13 -41.16 90.87 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.795 0.807 . . . . 0.0 109.734 179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -40.84 94.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.788 HG23 HD12 ' A' ' 748' ' ' LEU . 0.4 OUTLIER -69.26 -39.61 79.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.448 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 706' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 710' ' ' GLN . 1.7 m120 -62.3 -36.93 83.64 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.102 0.561 . . . . 0.0 111.493 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 9.0 ttm180 -62.59 -49.47 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.703 0.763 . . . . 0.0 110.252 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.04 -42.09 31.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.823 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -58.69 -41.37 86.09 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -174.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 710' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 706' ' ' ASN . 4.9 pt20 -101.97 -21.87 14.41 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -176.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 164.82 -128.11 1.74 Allowed Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.681 -0.637 . . . . 0.0 112.459 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 712' ' ' TYR . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 707' ' ' ARG . 0.1 OUTLIER -171.85 -116.84 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -178.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 713' ' ' SER . . . . . 0.436 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 7.3 m -62.83 159.4 45.36 Favored Pre-proline 0 C--N 1.352 0.687 0 O-C-N 120.641 -1.287 . . . . 0.0 109.083 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_exo -42.88 101.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.358 1.372 . . . . 0.0 111.699 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 715' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 716' ' ' SER . 0.2 OUTLIER -104.39 -20.79 13.62 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.362 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 716' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 121.997 0.903 . . . . 0.0 111.671 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.98 0.895 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -26.43 62.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.13 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.5 -9.94 0.57 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.8 mtm-85 -64.95 -46.36 81.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.349 -0.845 . . . . 0.0 111.208 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -63.44 -44.69 93.79 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.486 0.66 . . . . 0.0 111.685 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -71.19 -36.86 72.08 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.711 -0.618 . . . . 0.0 110.56 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 89.9 p -64.47 -42.21 96.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.759 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 746' ' ' ILE . . . . . 0.558 HD13 ' CD1' ' C' ' 781' ' ' ILE . 0.8 OUTLIER -64.96 -46.95 90.08 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.872 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.188 -178.744 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 747' ' ' ARG . . . . . 0.569 ' HB3' HD22 ' C' ' 785' ' ' LEU 0.32 14.3 ttt180 -70.26 -0.02 7.23 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 116.153 -2.219 . . . . 0.0 111.699 -176.844 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 748' ' ' LEU . . . . . 0.788 HD12 HG23 ' A' ' 705' ' ' VAL . 2.8 tm? -57.22 -15.5 6.03 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 169.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 749' ' ' VAL . . . . . 0.43 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.308 1.6 t -52.96 -54.37 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.719 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -72.86 -26.19 61.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 122.611 1.196 . . . . 0.0 108.458 174.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 751' ' ' GLY . . . . . 0.672 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.64 -19.27 27.05 Favored Glycine 0 C--N 1.341 0.831 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.822 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 11.1 p -57.23 -37.29 72.06 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.65 -47.69 84.22 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.12 -35.36 78.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.963 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 755' ' ' LEU . . . . . 0.696 ' O ' HD22 ' A' ' 755' ' ' LEU . 0.6 OUTLIER -59.26 -45.07 92.18 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.668 -0.645 . . . . 0.0 110.908 -177.92 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.7 mt -61.65 -37.75 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.62 -33.87 73.27 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.087 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 758' ' ' ASP . . . . . 0.814 ' OD1' HD22 ' B' ' 715' ' ' LEU . 17.7 m-20 -55.98 -45.11 79.06 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.823 0.82 . . . . 0.0 109.715 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.11 -41.38 74.06 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.432 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.23 -33.94 76.4 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 28.1 mtt85 -73.65 -25.8 60.45 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 60.5 p -77.02 -45.52 26.94 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.624 -0.673 . . . . 0.0 111.217 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 763' ' ' LEU . . . . . 0.695 ' HA ' HD13 ' A' ' 774' ' ' LEU . 10.4 mp -68.39 -54.94 13.84 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.01 -49.3 4.56 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.547 0.689 . . . . 0.0 112.493 -178.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 765' ' ' LEU . . . . . 0.457 HD23 ' CD ' ' B' ' 739' ' ' GLU . 1.1 tm? 88.62 -72.56 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.184 0.993 . . . . 0.0 109.658 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -118.67 -67.09 1.01 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.773 -0.58 . . . . 0.0 111.157 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.81 148.15 24.73 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.32 0.581 . . . . 0.0 110.842 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -62.62 -23.62 67.15 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.993 0.425 . . . . 0.0 110.878 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.868 0.842 . . . . 0.0 109.628 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -63.57 -29.82 71.02 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.482 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.461 HD22 ' HB3' ' A' ' 763' ' ' LEU . 0.1 OUTLIER -59.77 -45.27 92.77 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -179.393 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.02 -39.51 90.03 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.617 0.722 . . . . 0.0 109.322 177.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -64.64 -39.58 93.94 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.7 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -59.51 -38.74 81.75 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-O 121.109 0.481 . . . . 0.0 111.32 -179.615 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mt -58.63 -36.99 74.95 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.786 -0.571 . . . . 0.0 111.837 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 776' ' ' LEU . . . . . 0.479 HD12 ' N ' ' A' ' 776' ' ' LEU . 6.9 mp -74.04 -44.91 52.64 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.925 -0.484 . . . . 0.0 111.954 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 7.5 pt -64.4 -37.31 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.552 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 778' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 774' ' ' LEU . 79.3 t -57.45 -46.74 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.521 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 37.4 p -63.84 -35.99 82.44 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.21 1.005 . . . . 0.0 110.546 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -45.46 74.28 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.349 -0.842 . . . . 0.0 112.9 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 781' ' ' ILE . . . . . 0.531 HG13 HG21 ' B' ' 746' ' ' ILE . 11.6 pt -69.64 -36.77 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.39 -38.32 79.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.561 0 O-C-N 121.438 -0.789 . . . . 0.0 109.392 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -60.89 -43.47 98.44 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-O 121.545 0.688 . . . . 0.0 109.794 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.63 -39.57 84.66 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.59 0.71 . . . . 0.0 110.44 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.496 HD21 ' HG2' ' B' ' 747' ' ' ARG . 0.3 OUTLIER -72.84 -23.51 60.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.58 -179.49 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -76.55 52.38 3.11 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 14.1 ptt-85 -137.04 124.53 22.11 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 122.111 -0.641 . . . . 0.0 110.536 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 30.6 ttm-85 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.45 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.486 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.571 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.1 mm? 61.82 116.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.649 0.738 . . . . 0.0 110.529 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 177.65 178.45 0.32 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.396 0.617 . . . . 0.0 109.988 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.551 ' CD1' HD13 ' C' ' 660' ' ' LEU . 14.8 tp -50.97 -56.35 12.85 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 122.349 1.071 . . . . 0.0 110.71 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -20.21 65.92 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.793 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -81.15 -44.59 17.66 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.329 0.585 . . . . 0.0 110.25 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -74.91 -46.38 36.3 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.512 0.672 . . . . 0.0 111.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.82 63.39 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.559 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 54.4 p -71.58 -31.19 66.68 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.884 -0.51 . . . . 0.0 111.142 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.451 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.9 mm? -59.7 -30.72 68.99 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.09 0.472 . . . . 0.0 110.682 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -59.76 -22.9 62.74 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.06 0.457 . . . . 0.0 111.048 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.92 -24.92 23.47 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.148 0.499 . . . . 0.0 111.453 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.93 -51.61 66.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.281 0.562 . . . . 0.0 111.255 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 57.53 37.59 27.7 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.876 0.846 . . . . 0.0 110.724 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -140.06 -80.5 0.28 Allowed 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.843 -0.535 . . . . 0.0 110.461 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tt -68.2 -35.78 72.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 121.657 -0.652 . . . . 0.0 111.156 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -50.53 -33.41 21.52 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 121.982 -0.449 . . . . 0.0 111.716 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.72 -49.95 75.43 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.6 OUTLIER -65.88 -41.58 91.41 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 121.895 0.855 . . . . 0.0 109.591 177.521 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.492 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -62.22 -35.98 80.55 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -177.666 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -106.85 -26.31 11.3 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -79.57 -11.83 59.87 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.483 -0.761 . . . . 0.0 111.898 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.6 pt -60.66 -36.2 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.919 -0.488 . . . . 0.0 110.322 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -52.88 -47.35 67.93 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.29 -0.256 . . . . 0.0 110.682 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.487 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.3 mp -69.66 -36.11 68.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.5 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.9 -29.39 68.32 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.967 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.995 HD12 HG21 ' A' ' 686' ' ' ILE . 14.4 mm -61.21 -45.72 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 O-C-N 121.79 -0.569 . . . . 0.0 109.614 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 64.7 mt -65.63 -42.5 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.86 -37.78 68.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 685' ' ' PHE . 49.9 t -59.85 -48.88 86.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.76 -27.33 12.69 Favored Glycine 0 CA--C 1.541 1.693 0 O-C-N 121.691 -0.631 . . . . 0.0 112.054 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.1 m -60.65 -42.3 96.7 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.33 -32.75 70.37 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.457 -0.777 . . . . 0.0 112.108 -177.3 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.86 -47.83 85.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 O-C-N 121.704 -0.622 . . . . 0.0 109.618 -178.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.433 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -62.36 -32.83 84.25 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.548 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.7 tt -53.91 -36.43 62.72 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.287 1.042 . . . . 0.0 110.031 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.748 ' HG3' HD11 ' A' ' 693' ' ' ILE . 25.8 mmt180 -55.02 -27.63 45.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 124.104 0.961 . . . . 0.0 112.505 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.33 -36.1 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 O-C-N 120.832 -1.168 . . . . 0.0 108.844 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.548 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.7 p -64.51 -30.81 51.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.422 -0.799 . . . . 0.0 109.967 177.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.9 m-85 -56.65 -31.01 63.97 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.833 -0.542 . . . . 0.0 109.681 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.93 -37.52 76.89 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -41.57 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 176.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.9 tp -58.39 -39.12 78.8 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.825 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 50.2 m -64.07 -36.62 84.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.436 0.636 . . . . 0.0 109.813 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.464 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.3 OUTLIER -62.23 -43.28 99.19 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.28 1.038 . . . . 0.0 109.136 178.22 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 705' ' ' VAL . . . . . 0.718 HG22 HD23 ' B' ' 748' ' ' LEU . 93.8 t -69.82 -45.47 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.717 179.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 706' ' ' ASN . . . . . 0.485 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 7.6 m-20 -62.92 -39.64 95.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.404 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -48.59 60.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 0.0 111.401 -177.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.5 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.4 OUTLIER -76.66 -42.55 34.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -176.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.53 -45.24 94.57 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 710' ' ' GLN . . . . . 0.658 ' O ' HD11 ' B' ' 715' ' ' LEU . 5.5 pt20 -104.84 -24.54 12.87 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 144.5 160.18 8.39 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -100.79 -70.64 0.73 Allowed 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.731 -0.864 . . . . 0.0 112.795 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 713' ' ' SER . . . . . 0.411 ' O ' ' C ' ' B' ' 714' ' ' PRO . 1.6 m -63.24 159.46 48.62 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.717 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 714' ' ' PRO . . . . . 0.411 ' C ' ' O ' ' B' ' 713' ' ' SER . 3.7 Cg_exo -28.44 108.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 122.651 2.234 . . . . 0.0 112.614 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 715' ' ' LEU . . . . . 0.814 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.6 tt -75.94 -11.91 60.05 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 122.159 0.98 . . . . 0.0 111.942 -178.723 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 739' ' ' GLU . . . . . 0.457 ' CD ' HD23 ' A' ' 765' ' ' LEU . 31.3 tp10 . . . . . 0 N--CA 1.464 0.249 0 CA-C-O 121.798 0.809 . . . . 0.0 111.405 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -30.16 65.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.266 -178.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.0 -8.39 2.29 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -35.66 80.77 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.538 -0.726 . . . . 0.0 111.13 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -58.74 -42.39 88.67 Favored 'General case' 0 C--N 1.344 0.33 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -71.43 -35.56 70.98 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.834 177.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.2 m -57.1 -37.73 72.35 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.065 -0.397 . . . . 0.0 110.227 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 746' ' ' ILE . . . . . 0.531 HG21 HG13 ' A' ' 781' ' ' ILE . 1.4 mp -55.68 -17.69 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.564 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 747' ' ' ARG . . . . . 0.496 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.2 OUTLIER -59.52 -29.66 68.04 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.149 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 748' ' ' LEU . . . . . 0.718 HD23 HG22 ' B' ' 705' ' ' VAL . 12.7 tp -55.7 -18.54 8.32 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.082 0.468 . . . . 0.0 110.05 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 42.5 t -55.69 -53.34 38.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.658 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -71.96 -18.87 61.96 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.795 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 751' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.16 -20.46 35.54 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.053 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 67.5 p -58.6 -38.14 77.34 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.849 -0.795 . . . . 0.0 109.408 179.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.84 -50.73 63.55 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.461 0.648 . . . . 0.0 109.62 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.84 -35.53 81.43 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.3 tt -59.84 -45.51 92.2 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.794 -0.567 . . . . 0.0 110.756 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.29 -37.78 80.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.652 0.739 . . . . 0.0 109.178 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.08 -30.31 68.6 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.342 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 758' ' ' ASP . . . . . 0.406 ' OD2' HD23 ' C' ' 715' ' ' LEU . 70.7 m-20 -55.58 -49.79 71.8 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.844 -1.16 . . . . 0.0 109.281 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.67 -45.89 60.58 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.42 0.628 . . . . 0.0 112.45 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 -46.72 65.37 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 8.9 ttm-85 -64.26 -49.94 69.91 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -177.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 3.0 m -62.27 -43.56 98.55 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.999 -0.438 . . . . 0.0 111.684 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 763' ' ' LEU . . . . . 0.589 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -60.89 -53.84 52.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.509 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 60.2 p -98.06 -49.24 4.83 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.396 0.617 . . . . 0.0 112.348 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 24.6 tp 69.15 102.92 0.06 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.867 0.842 . . . . 0.0 110.333 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 42.6 t80 64.6 -77.93 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.925 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 20.0 m -95.73 151.82 19.02 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.597 -0.689 . . . . 0.0 111.356 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.26 -30.88 43.28 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.864 0.364 . . . . 0.0 110.5 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -53.34 -40.44 64.9 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.92 0.867 . . . . 0.0 109.357 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.1 tpt85 -58.24 -29.49 65.79 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.578 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.95 -34.96 72.38 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -64.14 -35.03 79.46 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.98 -46.95 73.06 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 774' ' ' LEU . . . . . 0.628 ' HG ' HD11 ' B' ' 777' ' ' ILE . 1.5 tt -63.25 -37.98 89.37 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.953 0.882 . . . . 0.0 110.264 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 775' ' ' LEU . . . . . 0.566 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.3 OUTLIER -60.97 -37.06 81.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.836 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 776' ' ' LEU . . . . . 0.531 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.48 -44.86 63.95 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.931 -0.481 . . . . 0.0 111.688 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 777' ' ' ILE . . . . . 0.628 HD11 ' HG ' ' B' ' 774' ' ' LEU . 1.7 pp -64.5 -36.97 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.734 -0.604 . . . . 0.0 109.49 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 778' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' B' ' 781' ' ' ILE . 51.8 t -57.31 -46.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 O-C-N 121.678 -0.639 . . . . 0.0 111.028 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 779' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.8 t -63.5 -35.57 80.88 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.557 -0.714 . . . . 0.0 112.158 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -31.5 71.81 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.68 -0.638 . . . . 0.0 111.308 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 781' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' B' ' 778' ' ' VAL . 79.8 mt -60.42 -42.69 91.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.081 -0.387 . . . . 0.0 111.585 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 782' ' ' VAL . . . . . 0.601 HG22 ' O ' ' B' ' 779' ' ' THR . 6.7 m -54.93 -38.81 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.334 -0.854 . . . . 0.0 110.061 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.32 -45.56 92.68 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.596 0.713 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 17.5 tp -66.12 -43.97 85.6 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.293 0.568 . . . . 0.0 111.078 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 785' ' ' LEU . . . . . 0.463 HD23 ' CG ' ' C' ' 750' ' ' ASN . 4.2 tp -77.12 -16.47 59.16 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.074 0.464 . . . . 0.0 111.273 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.3 -48.11 15.91 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.88 106.99 19.38 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.524 -179.467 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.551 HD13 ' CD1' ' B' ' 663' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 121.496 0.665 . . . . 0.0 109.286 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.526 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.8 mp 60.68 120.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.621 0.725 . . . . 0.0 111.555 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.55 169.21 3.13 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.426 0.631 . . . . 0.0 110.059 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.732 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.3 OUTLIER -57.08 -52.07 66.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.763 0.792 . . . . 0.0 109.679 179.357 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.624 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -72.71 -17.15 61.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.853 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -81.07 -44.26 18.27 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.027 0.441 . . . . 0.0 111.189 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -63.95 -46.28 85.41 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.45 0.643 . . . . 0.0 110.284 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.48 -26.53 68.76 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.533 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -63.75 -37.97 89.37 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.047 0.451 . . . . 0.0 111.723 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.18 -34.78 74.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.869 0.366 . . . . 0.0 111.629 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -59.67 -21.96 61.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.036 0.446 . . . . 0.0 111.285 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -79.61 -24.54 41.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.173 0.511 . . . . 0.0 111.26 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -58.77 -37.63 76.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.507 0.67 . . . . 0.0 110.352 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 59.09 27.48 16.45 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.008 178.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.71 -68.81 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.548 -0.72 . . . . 0.0 112.227 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.703 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -58.05 -37.93 64.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.517 0.675 . . . . 0.0 111.083 -178.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.54 -33.84 47.36 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.958 -0.463 . . . . 0.0 111.149 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -62.95 -50.03 72.42 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.037 0.446 . . . . 0.0 110.343 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.701 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.69 -44.2 86.92 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.284 0.564 . . . . 0.0 109.801 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.559 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.55 -35.76 82.01 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.06 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -95.51 -33.52 12.4 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -75.36 -16.37 60.39 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.788 -0.57 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.701 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.0 pp -60.54 -36.77 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.877 -0.514 . . . . 0.0 110.304 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.556 ' N ' HD12 ' C' ' 682' ' ' ILE . 9.5 ttt-85 -57.04 -47.34 81.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.216 0.531 . . . . 0.0 110.005 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.427 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -66.81 -35.73 75.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.406 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.81 -32.03 70.26 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.867 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.942 HG21 HD12 ' A' ' 686' ' ' ILE . 9.6 mm -60.86 -49.51 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.327 0.584 . . . . 0.0 109.95 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -65.27 -36.94 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.8 -37.94 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.406 HG23 ' O ' ' C' ' 685' ' ' PHE . 73.5 t -55.73 -39.99 58.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.18 -40.32 91.44 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 9.8 m -63.26 -39.41 94.53 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 122.167 0.984 . . . . 0.0 109.817 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -46.15 89.2 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.318 -177.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.85 -42.12 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 694' ' ' GLY . . . . . 0.622 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.51 -32.28 77.4 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.66 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.3 tt -58.22 -38.41 76.74 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.997 0.903 . . . . 0.0 109.645 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -55.95 -28.13 55.6 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.622 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.8 tt -58.06 -36.35 56.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 120.924 -1.11 . . . . 0.0 111.141 -175.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.66 HG12 ' O ' ' C' ' 695' ' ' LEU . 13.9 p -54.86 -29.51 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 121.402 -0.812 . . . . 0.0 109.375 176.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.43 -31.58 64.06 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.171 -0.956 . . . . 0.0 109.619 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 700' ' ' ALA . . . . . 0.434 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.48 -43.01 97.41 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 52.7 t -68.33 -36.24 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.698 177.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.82 -37.03 82.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.366 0.667 . . . . 0.0 109.773 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.6 m -62.19 -36.45 81.95 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.219 0.533 . . . . 0.0 110.518 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -41.35 97.91 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 122.153 0.977 . . . . 0.0 108.708 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 705' ' ' VAL . . . . . 0.533 ' HA ' HD11 ' C' ' 748' ' ' LEU . 60.5 t -65.58 -44.53 93.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-O 122.176 0.988 . . . . 0.0 108.952 178.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.35 -35.88 80.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.333 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -49.69 75.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 121.685 -0.634 . . . . 0.0 110.532 -178.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -44.67 32.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.435 0.636 . . . . 0.0 111.766 -178.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -73.36 -39.85 64.84 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.377 -178.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -102.67 -18.89 15.0 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 102.31 171.11 27.08 Favored Glycine 0 CA--C 1.536 1.348 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 712' ' ' TYR . . . . . 0.464 ' O ' HD11 ' B' ' 704' ' ' LEU . 15.1 p90 -119.13 -54.29 2.22 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.681 -0.893 . . . . 0.0 112.297 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 713' ' ' SER . . . . . 0.5 ' HA ' HG21 ' B' ' 708' ' ' VAL . 87.6 p -94.44 159.42 33.84 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-O 118.752 -0.642 . . . . 0.0 110.423 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -39.55 103.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.668 1.579 . . . . 0.0 111.749 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 715' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' C' ' 716' ' ' SER . 27.7 tp -85.81 -19.89 30.0 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 716' ' ' SER . . . . . 0.479 ' C ' ' O ' ' C' ' 715' ' ' LEU . 35.5 t . . . . . 0 N--CA 1.5 2.052 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.58 0.705 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -61.7 -33.26 73.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.346 0.593 . . . . 0.0 111.088 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -58.32 -38.23 76.7 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.113 0.482 . . . . 0.0 110.95 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 742' ' ' ARG . . . . . 0.464 ' HD2' HD11 ' B' ' 774' ' ' LEU . 26.2 mtm105 -63.24 -42.67 99.23 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 122.175 -0.328 . . . . 0.0 111.153 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -58.03 -38.42 76.2 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.41 0.624 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -71.1 -42.54 69.17 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.375 0.607 . . . . 0.0 109.573 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.28 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.123 -0.361 . . . . 0.0 111.051 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 746' ' ' ILE . . . . . 0.416 HG21 ' HB ' ' B' ' 781' ' ' ILE . 1.5 mp -57.58 -21.0 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 120.039 -0.664 . . . . 0.0 109.717 178.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -59.67 -28.13 66.99 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.359 -0.838 . . . . 0.0 109.074 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 748' ' ' LEU . . . . . 0.591 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.2 tt -55.98 -24.49 39.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 53.8 t -55.59 -54.6 24.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 750' ' ' ASN . . . . . 0.463 ' CG ' HD23 ' B' ' 785' ' ' LEU . 6.9 m120 -72.9 -26.76 61.54 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.094 0.95 . . . . 0.0 109.233 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.32 -20.83 38.12 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.241 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 74.7 m -60.51 -38.02 83.0 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.919 -0.754 . . . . 0.0 109.429 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.61 -50.1 54.12 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.352 0.596 . . . . 0.0 110.159 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.71 80.24 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -60.38 -45.46 93.46 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.311 0.577 . . . . 0.0 110.383 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 54.5 mt -65.62 -36.91 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.894 0.854 . . . . 0.0 108.717 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.22 -30.6 68.79 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.933 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -55.56 -46.01 77.22 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.571 -0.706 . . . . 0.0 110.244 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.25 -41.9 72.91 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.283 0.563 . . . . 0.0 110.987 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -33.34 75.5 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -81.95 -38.93 24.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -44.52 61.89 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.246 -0.909 . . . . 0.0 109.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 763' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' C' ' 771' ' ' LEU . 5.2 tt -64.23 -53.66 45.63 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.502 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 764' ' ' SER . . . . . 0.528 ' HB2' HD12 ' C' ' 771' ' ' LEU . 46.6 t -97.81 -49.24 4.89 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.529 -0.732 . . . . 0.0 112.496 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.17 98.53 0.07 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 122.036 0.922 . . . . 0.0 110.914 -178.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 62.9 t80 48.88 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.417 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 20.3 t -73.9 154.01 39.59 Favored 'General case' 0 C--N 1.346 0.418 0 O-C-N 121.325 -0.859 . . . . 0.0 110.598 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 768' ' ' TYR . . . . . 0.469 ' CE2' HD13 ' C' ' 771' ' ' LEU . 0.3 OUTLIER -76.24 -19.46 58.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.93 0.395 . . . . 0.0 110.761 179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -43.72 88.37 Favored 'General case' 0 C--N 1.345 0.375 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.5 mmt-85 -58.73 -30.77 67.72 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.487 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 771' ' ' LEU . . . . . 0.744 ' O ' HD23 ' C' ' 771' ' ' LEU . 4.4 tt -60.67 -32.6 71.79 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.08 0.467 . . . . 0.0 109.842 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.31 -37.78 70.39 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -63.98 -34.72 78.64 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 774' ' ' LEU . . . . . 0.472 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -58.64 -38.68 78.62 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-O 121.074 0.464 . . . . 0.0 110.355 179.404 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 775' ' ' LEU . . . . . 0.426 ' O ' HG22 ' C' ' 778' ' ' VAL . 4.1 mm? -59.24 -43.25 92.39 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.564 0.697 . . . . 0.0 110.623 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 50.3 mt -74.34 -34.7 63.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.603 0.716 . . . . 0.0 110.182 178.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.03 -43.15 95.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.523 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 778' ' ' VAL . . . . . 0.527 HG12 HG12 ' A' ' 746' ' ' ILE . 34.6 m -64.93 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.191 -179.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 779' ' ' THR . . . . . 0.773 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.2 OUTLIER -63.79 -48.11 78.21 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.843 -0.535 . . . . 0.0 111.784 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -31.41 71.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.143 0.497 . . . . 0.0 111.769 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 781' ' ' ILE . . . . . 0.558 ' CD1' HD13 ' A' ' 746' ' ' ILE . 21.2 mt -57.85 -36.88 57.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 782' ' ' VAL . . . . . 0.773 HG22 ' O ' ' C' ' 779' ' ' THR . 33.9 m -53.2 -37.77 28.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.518 0 CA-C-N 119.35 0.977 . . . . 0.0 110.94 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.6 -41.59 90.67 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.855 -0.528 . . . . 0.0 112.074 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 16.3 tp -70.15 -44.59 68.51 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -176.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 785' ' ' LEU . . . . . 0.569 HD22 ' HB3' ' A' ' 747' ' ' ARG . 3.4 tp -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.969 -1.082 . . . . 0.0 110.389 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -40.92 -48.06 4.17 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 116.442 -0.345 . . . . 0.0 112.451 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.35 100.07 10.5 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.808 0.813 . . . . 0.0 111.181 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.365 179.945 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.616 ' N ' HD23 ' C' ' 663' ' ' LEU . 1.4 mt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 69.0 mt 57.97 116.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.981 0.896 . . . . 0.0 112.117 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -176.63 175.04 1.76 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.532 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.425 ' C ' HD23 ' A' ' 663' ' ' LEU . 10.3 tt -50.67 -39.87 52.17 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.504 0.668 . . . . 0.0 110.837 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -74.37 -36.07 63.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.51 0.671 . . . . 0.0 111.7 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -43.21 78.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 111.301 -179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -67.16 -46.27 74.5 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.498 0.666 . . . . 0.0 110.242 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.59 -38.0 83.4 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.469 0.652 . . . . 0.0 110.758 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.8 m -60.41 -33.82 73.05 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.347 0.594 . . . . 0.0 111.115 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.0 tp -61.28 -25.52 67.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.87 0.367 . . . . 0.0 111.605 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -59.84 -25.87 65.35 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.766 -0.584 . . . . 0.0 110.799 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -64.12 -27.28 68.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.204 0.526 . . . . 0.0 111.15 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -59.68 -52.51 65.2 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.766 0.793 . . . . 0.0 110.215 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 26.1 t80 64.12 24.72 13.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.116 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -143.5 -61.93 0.4 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.67 -0.644 . . . . 0.0 111.338 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.7 tp -67.58 -37.68 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.395 0.617 . . . . 0.0 110.574 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -52.95 -34.24 54.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -67.33 -50.14 61.23 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.218 0.533 . . . . 0.0 111.31 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.554 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.6 OUTLIER -66.2 -43.35 87.0 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.425 0.631 . . . . 0.0 109.823 179.027 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.414 HD23 HG13 ' A' ' 675' ' ' ILE . 2.3 mm? -66.37 -35.91 81.53 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -99.58 8.37 44.5 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -176.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -120.24 -10.89 9.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.514 -0.742 . . . . 0.0 112.088 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.554 HG23 ' O ' ' A' ' 678' ' ' TRP . 6.8 pt -61.6 -35.73 68.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 121.867 -0.521 . . . . 0.0 110.527 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -47.29 68.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.036 -0.415 . . . . 0.0 110.765 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.455 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -68.86 -35.96 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.534 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.7 OUTLIER -59.96 -28.12 67.39 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.427 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.923 HD12 HG21 ' C' ' 686' ' ' ILE . 18.2 mm -60.79 -46.14 96.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.284 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 62.6 mt -64.67 -38.48 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.2 -37.19 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.3 t -54.55 -40.4 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.66 -39.37 85.94 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 177.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.3 m -66.66 -38.36 86.7 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.722 0.772 . . . . 0.0 109.413 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.39 -46.31 89.03 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.72 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.746 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.99 -40.56 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.439 -179.561 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.47 -24.2 61.37 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -38.2 82.76 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.88 0.848 . . . . 0.0 109.632 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.6 mmt180 -55.5 -28.17 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.486 0.715 . . . . 0.0 112.243 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.15 -39.42 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -177.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.76 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.63 -30.49 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 O-C-N 121.609 -0.682 . . . . 0.0 109.704 176.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -55.95 -29.06 59.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.92 0.39 . . . . 0.0 110.445 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.04 71.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.76 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -59.56 -35.85 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.025 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.73 -39.45 77.33 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 58.1 m -62.72 -38.29 89.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.581 0.705 . . . . 0.0 109.794 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -45.72 93.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.31 1.052 . . . . 0.0 108.571 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.53 HG22 HD12 ' A' ' 748' ' ' LEU . 93.3 t -62.35 -45.27 99.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.12 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 3.2 m120 -62.68 -38.45 90.44 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.244 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.656 HH21 HG23 ' A' ' 708' ' ' VAL . 4.5 tmm_? -62.61 -45.94 90.57 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.805 -0.559 . . . . 0.0 111.0 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.656 HG23 HH21 ' A' ' 707' ' ' ARG . 1.2 t -76.19 -42.01 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-O 122.233 1.016 . . . . 0.0 109.033 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -70.56 -18.93 62.92 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 27.5 tt0 -86.72 -13.47 45.25 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.499 0.666 . . . . 0.0 111.876 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 97.09 46.61 2.38 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.1 t80 52.18 -127.73 2.41 Favored 'General case' 0 CA--C 1.564 1.5 0 O-C-N 122.0 -0.706 . . . . 0.0 109.8 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 66.2 m -62.25 130.9 93.41 Favored Pre-proline 0 C--N 1.347 0.49 0 O-C-N 120.987 -1.071 . . . . 0.0 109.378 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.507 ' CG ' HD21 ' C' ' 748' ' ' LEU . 71.9 Cg_exo -43.59 106.62 0.08 OUTLIER 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 121.111 1.207 . . . . 0.0 111.922 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -99.61 -5.4 29.09 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.44 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 3.8 t . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 122.507 1.146 . . . . 0.0 109.18 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 121.872 0.844 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -57.74 -26.09 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.634 0.73 . . . . 0.0 110.739 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.8 -22.78 26.34 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.665 ' O ' HD12 ' A' ' 746' ' ' ILE . 5.8 mtm105 -65.63 -46.62 78.56 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.663 -0.648 . . . . 0.0 112.472 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -44.62 91.52 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.75 -0.594 . . . . 0.0 110.827 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -40.15 72.48 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.125 -0.36 . . . . 0.0 111.331 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 61.9 p -65.5 -33.46 75.98 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 122.203 -0.311 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.4 OUTLIER -63.17 -46.45 95.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.28 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.509 ' CD ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -62.09 -8.71 5.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.171 -1.412 . . . . 0.0 111.313 -177.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 705' ' ' VAL . 0.2 OUTLIER -55.73 -14.94 2.55 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.486 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.316 1.9 t -52.97 -54.59 16.06 Favored 'Isoleucine or valine' 0 C--N 1.35 0.595 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 176.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.518 HD22 ' H ' ' A' ' 750' ' ' ASN . 2.3 m-80 -73.36 -28.58 62.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.06 -1.427 . . . . 0.0 109.103 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.78 -19.9 30.57 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.035 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 78.6 p -57.93 -37.74 74.64 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 36.8 tp -62.1 -50.87 70.2 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.16 72.4 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.629 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.441 ' C ' HD23 ' A' ' 755' ' ' LEU . 9.9 tt -58.97 -44.05 91.48 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.62 -0.675 . . . . 0.0 110.768 -178.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.8 mt -61.56 -36.97 76.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.62 68.84 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.228 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.656 ' OD2' HD22 ' B' ' 715' ' ' LEU . 51.5 m-20 -55.58 -43.85 76.36 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.383 0.611 . . . . 0.0 109.805 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.46 -41.08 73.26 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 110.682 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.65 -33.54 76.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.711 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -77.42 -30.84 53.66 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 6.5 p -77.33 -45.25 26.73 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.359 -0.838 . . . . 0.0 110.342 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.462 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -68.12 -53.72 23.3 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -178.183 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 92.0 p -98.13 -49.15 4.84 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.538 -0.726 . . . . 0.0 112.69 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 17.4 tp 101.29 -87.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.318 1.447 . . . . 0.0 110.689 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -110.8 -70.68 0.8 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.468 -0.77 . . . . 0.0 110.976 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.4 t -87.25 158.74 19.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.201 0.524 . . . . 0.0 110.322 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -83.11 13.26 4.23 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.037 0.446 . . . . 0.0 111.529 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -98.93 -41.73 7.46 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.622 0.725 . . . . 0.0 109.321 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -56.04 -29.91 61.13 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.753 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -31.02 69.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.051 -0.406 . . . . 0.0 111.244 -177.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ptt85 -57.49 -40.18 78.07 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.612 0.72 . . . . 0.0 109.637 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.39 -42.98 74.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.048 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.3 tt -60.57 -38.42 84.5 Favored 'General case' 0 C--N 1.349 0.56 0 CA-C-O 121.438 0.637 . . . . 0.0 110.459 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -35.76 72.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.146 0.974 . . . . 0.0 109.328 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.95 -44.95 65.01 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.399 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.716 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -65.82 -37.3 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.91 -0.494 . . . . 0.0 111.056 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.716 ' N ' HD13 ' A' ' 777' ' ' ILE . 17.4 m -60.81 -46.54 96.0 Favored 'Isoleucine or valine' 0 C--N 1.35 0.588 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.271 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.78 ' O ' HG22 ' A' ' 782' ' ' VAL . 7.2 m -64.22 -36.91 85.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-O 121.824 0.821 . . . . 0.0 109.674 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . 0.442 ' HD3' HD13 ' A' ' 784' ' ' LEU . 2.2 ttt85 -65.58 -30.35 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.944 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.74 HG21 ' CG2' ' B' ' 746' ' ' ILE . 3.5 tp -53.49 -36.57 27.92 Favored 'Isoleucine or valine' 0 C--N 1.348 0.529 0 O-C-N 121.887 -0.508 . . . . 0.0 111.28 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 779' ' ' THR . 16.7 m -55.09 -38.11 45.19 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 C-N-CA 119.354 -0.939 . . . . 0.0 110.271 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -64.91 -46.58 81.11 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.509 0.671 . . . . 0.0 110.756 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.442 HD13 ' HD3' ' A' ' 780' ' ' ARG . 7.2 mp -64.47 -40.9 96.56 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.527 0.679 . . . . 0.0 111.39 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.503 HD23 ' ND2' ' B' ' 750' ' ' ASN . 59.4 tp . . . . . 0 CA--C 1.548 0.876 0 CA-C-O 121.102 0.477 . . . . 0.0 111.746 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.435 HD12 ' N ' ' B' ' 660' ' ' LEU . 7.0 mp . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.561 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.0 mm? 60.92 116.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.313 0.577 . . . . 0.0 110.506 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -173.72 161.98 3.98 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.347 0.594 . . . . 0.0 109.64 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.538 HD11 HD13 ' C' ' 660' ' ' LEU . 9.4 tt -55.41 -43.99 75.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.656 0.741 . . . . 0.0 110.31 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.18 -28.62 67.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.376 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.0 tptt -75.57 -48.9 20.36 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.045 0.45 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.416 ' CE2' HD22 ' C' ' 661' ' ' LEU . 83.7 m95 -58.55 -45.99 87.77 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.616 0.722 . . . . 0.0 110.39 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.22 66.66 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.681 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 27.6 t -72.32 -26.82 62.09 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.987 0.422 . . . . 0.0 111.545 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.37 -39.16 92.26 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.964 -0.46 . . . . 0.0 111.602 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -59.73 -20.36 56.0 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.931 -0.481 . . . . 0.0 111.355 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -82.07 -24.43 35.26 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.292 0.568 . . . . 0.0 111.006 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -68.9 -47.27 66.22 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.511 0.672 . . . . 0.0 110.626 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 44.2 t80 58.28 32.17 21.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.68 0.752 . . . . 0.0 111.31 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -140.26 -70.83 0.38 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.815 -0.553 . . . . 0.0 110.662 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.15 -37.5 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 121.848 -0.532 . . . . 0.0 111.081 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -52.56 -35.46 53.81 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 24.7 m120 -62.83 -50.08 72.36 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.493 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.503 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.7 t90 -66.24 -43.77 85.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.982 0.896 . . . . 0.0 109.638 177.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.66 -35.72 78.75 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.127 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -94.79 -50.83 4.97 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -53.33 -18.2 2.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.802 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.9 pp -60.51 -36.65 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.759 -0.588 . . . . 0.0 110.544 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . 0.802 ' N ' HD12 ' B' ' 682' ' ' ILE . 14.1 ttt-85 -58.25 -47.46 83.49 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.908 -0.495 . . . . 0.0 110.93 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.477 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.04 -34.48 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -27.94 69.2 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.253 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.813 HD12 HG21 ' A' ' 686' ' ' ILE . 18.5 mm -60.7 -50.87 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.417 0.627 . . . . 0.0 110.213 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.68 -40.4 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.27 0.557 . . . . 0.0 109.524 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.52 -38.9 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.85 -48.12 90.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.51 -27.0 10.89 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.769 -0.582 . . . . 0.0 111.744 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 5.4 m -60.81 -45.27 95.09 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.619 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.26 -32.39 69.96 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.651 -0.656 . . . . 0.0 112.546 -176.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.619 ' H ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.88 -46.36 87.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 O-C-N 121.725 -0.609 . . . . 0.0 110.165 -178.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.98 -31.73 79.61 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.64 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.2 tt -57.66 -36.55 72.04 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.493 1.139 . . . . 0.0 110.389 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.746 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.5 mmt180 -55.59 -28.88 57.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -36.68 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.907 -1.121 . . . . 0.0 110.251 -176.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.64 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.36 -30.85 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.444 -0.785 . . . . 0.0 110.92 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -56.71 -31.42 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.857 -0.527 . . . . 0.0 110.404 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.4 80.37 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.51 -38.06 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.96 -37.68 88.47 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.157 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 59.6 p -64.06 -34.55 78.27 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.212 0.53 . . . . 0.0 110.743 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -43.12 94.73 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.129 0.966 . . . . 0.0 109.161 178.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' B' ' 748' ' ' LEU . 93.5 t -68.98 -44.92 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.15 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.54 -36.15 81.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -62.04 -50.03 73.63 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 122.071 0.939 . . . . 0.0 109.999 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.562 ' CG1' HD12 ' B' ' 748' ' ' LEU . 1.7 t -77.57 -44.07 29.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.921 -1.036 . . . . 0.0 113.239 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -57.79 -44.24 86.13 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 6.6 pt20 -103.79 -23.76 13.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.58 128.51 3.0 Favored Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -71.19 -60.55 2.17 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.75 152.28 90.59 Favored Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 121.152 -0.967 . . . . 0.0 110.58 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.461 ' HG3' HD23 ' A' ' 748' ' ' LEU . 69.4 Cg_exo -32.72 113.49 0.06 OUTLIER 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.563 2.176 . . . . 0.0 112.501 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.656 HD22 ' OD2' ' A' ' 758' ' ' ASP . 6.0 tt -77.3 -16.33 59.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 122.097 0.951 . . . . 0.0 112.126 -178.976 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 121.002 0.43 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -28.15 63.16 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.081 0.467 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.16 -7.12 3.66 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.692 HH11 HD11 ' A' ' 777' ' ' ILE . 8.2 ttp-105 -68.19 -40.25 82.28 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.806 -0.559 . . . . 0.0 111.623 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.11 -43.68 87.31 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.243 0.544 . . . . 0.0 109.715 -179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' B' ' 747' ' ' ARG . 0.0 OUTLIER -71.33 -39.33 71.45 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.188 178.085 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.6 p -56.94 -34.41 67.97 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 121.326 -0.858 . . . . 0.0 110.957 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.74 ' CG2' HG21 ' A' ' 781' ' ' ILE . 87.1 mt -52.88 -25.2 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.478 -0.773 . . . . 0.0 112.287 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 744' ' ' ARG . 0.0 OUTLIER -59.67 -28.48 67.31 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.783 1.629 . . . . 0.0 109.132 179.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.562 HD12 ' CG1' ' B' ' 708' ' ' VAL . 3.5 mt -55.9 -16.36 4.56 Favored 'General case' 0 C--N 1.353 0.741 0 O-C-N 121.75 -0.594 . . . . 0.0 110.696 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 31.8 t -56.54 -54.13 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 106.978 -1.489 . . . . 0.0 106.978 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.503 ' ND2' HD23 ' A' ' 785' ' ' LEU . 3.0 m-80 -72.68 -16.37 61.69 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.473 175.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.19 -20.58 36.21 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.716 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 14.4 m -58.72 -37.93 77.2 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.999 0.9 . . . . 0.0 109.882 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.78 -51.05 37.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.483 0.658 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.92 76.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.232 0.539 . . . . 0.0 111.67 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.589 HD21 HE22 ' C' ' 710' ' ' GLN . 9.5 tt -59.12 -45.36 91.13 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.907 -0.496 . . . . 0.0 110.734 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.4 mt -66.08 -36.27 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 122.135 0.969 . . . . 0.0 108.844 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.12 -29.53 69.3 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.834 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -54.94 -48.21 73.45 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.586 -0.697 . . . . 0.0 109.466 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.92 -45.48 64.19 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.14 -46.43 74.09 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -64.9 -29.74 70.7 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.819 -0.55 . . . . 0.0 112.372 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 80.0 p -75.71 -45.47 36.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.543 0.687 . . . . 0.0 110.95 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.439 ' O ' HD13 ' B' ' 774' ' ' LEU . 2.0 mp -61.07 -54.77 40.64 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 13.7 p -98.71 -49.62 4.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.528 0.68 . . . . 0.0 112.678 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 12.8 tp 71.1 99.66 0.06 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.718 0.77 . . . . 0.0 110.47 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.89 -80.94 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.207 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 17.6 p -84.31 158.32 21.22 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.638 -0.664 . . . . 0.0 110.558 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . 0.516 ' CE2' HD13 ' B' ' 771' ' ' LEU . 18.3 t80 -89.52 -31.76 17.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.96 0.409 . . . . 0.0 110.902 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.26 -37.71 64.99 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.999 0.904 . . . . 0.0 109.199 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -56.22 -29.77 61.41 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.546 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' B' ' 768' ' ' TYR . 10.0 tt -59.65 -41.0 89.54 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.905 -0.497 . . . . 0.0 109.698 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -57.74 -42.91 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.94 -46.17 90.5 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.439 HD13 ' O ' ' B' ' 763' ' ' LEU . 0.8 OUTLIER -59.25 -37.77 78.41 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.741 0.782 . . . . 0.0 109.997 178.284 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.624 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.5 OUTLIER -58.07 -36.91 73.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.074 -178.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 49.5 mt -70.71 -48.34 55.09 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.585 -0.697 . . . . 0.0 111.364 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 18.4 pt -62.58 -36.12 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.899 0.38 . . . . 0.0 109.98 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.411 HG23 HG12 ' C' ' 746' ' ' ILE . 0.4 OUTLIER -54.81 -45.79 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.11 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.606 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -63.83 -36.03 82.56 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.641 0.734 . . . . 0.0 110.492 178.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -67.08 -37.88 84.75 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 64.1 mt -63.92 -41.59 93.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.999 -0.438 . . . . 0.0 111.266 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.606 HG22 ' O ' ' B' ' 779' ' ' THR . 6.8 m -58.14 -38.58 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 121.282 -0.886 . . . . 0.0 110.176 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -59.97 -42.08 93.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.725 0.774 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.59 -43.36 85.1 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.605 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.783 HD23 ' HB2' ' C' ' 750' ' ' ASN . 5.9 tp -82.36 -18.31 42.56 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 122.05 -0.406 . . . . 0.0 111.604 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -50.76 -42.94 46.76 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 118.89 36.62 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.759 -179.414 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.538 HD13 HD11 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.429 ' N ' HD12 ' C' ' 661' ' ' LEU . 8.3 mp 59.02 109.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.712 0.768 . . . . 0.0 110.807 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -173.11 165.74 4.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.488 0.661 . . . . 0.0 110.243 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.677 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -50.7 -55.74 15.14 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.486 0.66 . . . . 0.0 110.591 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.677 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.6 t70 -71.03 -19.66 62.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.538 . . . . 0.0 112.384 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -80.61 -44.71 18.48 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.074 -0.391 . . . . 0.0 111.187 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -64.64 -45.76 85.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.407 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.24 -19.3 65.78 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.936 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 15.7 p -72.17 -28.63 63.35 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.815 -0.553 . . . . 0.0 111.327 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.33 -38.66 87.7 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 122.106 -0.372 . . . . 0.0 111.621 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -59.58 -29.79 68.2 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.599 -0.688 . . . . 0.0 110.985 -178.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -63.94 -31.99 73.36 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.472 0.653 . . . . 0.0 110.624 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -63.31 -41.65 98.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.495 0.664 . . . . 0.0 110.371 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 52.18 36.75 20.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.542 0.687 . . . . 0.0 111.334 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -146.59 -72.0 0.23 Allowed 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.604 -0.685 . . . . 0.0 111.338 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' C' ' 678' ' ' TRP . 6.2 tp -67.78 -37.5 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.952 -0.468 . . . . 0.0 110.981 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -52.24 -34.69 47.16 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -66.06 -50.15 65.17 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.712 -0.618 . . . . 0.0 110.451 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.426 ' CE3' HD12 ' C' ' 675' ' ' ILE . 1.3 t90 -65.81 -43.85 87.4 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 121.617 0.722 . . . . 0.0 109.727 178.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.469 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -64.05 -35.89 82.22 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.98 -8.0 22.81 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -97.81 -11.66 23.06 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.378 -0.826 . . . . 0.0 112.927 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.91 -36.6 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 O-C-N 121.744 -0.597 . . . . 0.0 110.499 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.517 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.8 ttt-85 -54.09 -47.42 71.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.776 0.322 . . . . 0.0 111.1 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.467 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.2 mp -68.81 -35.95 71.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.79 -32.37 70.55 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.92 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.923 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.61 -44.34 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.35 -41.62 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.88 -37.69 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.475 ' O ' HG23 ' C' ' 693' ' ' ILE . 94.0 t -54.95 -39.8 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.22 -42.52 82.44 Favored Glycine 0 C--N 1.346 1.137 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.4 -38.7 90.74 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.991 0.9 . . . . 0.0 109.021 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 tp -59.87 -43.99 94.42 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.083 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.475 HG23 ' O ' ' C' ' 689' ' ' VAL . 1.2 pp -65.63 -41.86 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.979 -0.45 . . . . 0.0 109.91 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -64.25 -27.74 71.99 Favored Glycine 0 CA--C 1.537 1.429 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.604 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -60.86 -39.46 89.25 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.877 0.846 . . . . 0.0 110.113 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.25 -29.17 60.72 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.744 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.1 OUTLIER -59.26 -36.21 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -176.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.604 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.3 p -54.38 -30.6 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.317 -0.864 . . . . 0.0 110.631 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -56.45 -31.32 63.86 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.999 -0.438 . . . . 0.0 110.281 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.72 79.0 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 177.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -43.44 92.8 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 122.07 0.938 . . . . 0.0 108.565 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.9 -37.67 87.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.403 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.3 m -62.76 -39.17 93.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.196 0.522 . . . . 0.0 110.343 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.494 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.7 OUTLIER -62.12 -44.98 95.46 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.21 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.62 -45.16 99.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.85 0.833 . . . . 0.0 108.892 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -62.6 -37.0 84.54 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.373 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.31 -49.78 71.29 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -36.02 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.36 0.6 . . . . 0.0 111.95 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -70.36 -44.25 68.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.589 HE22 HD21 ' B' ' 755' ' ' LEU . 0.0 OUTLIER -103.04 -21.49 13.92 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -179.046 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.01 178.54 17.8 Favored Glycine 0 CA--C 1.537 1.448 0 N-CA-C 110.194 -1.162 . . . . 0.0 110.194 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -132.9 -54.42 0.93 Allowed 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.896 -0.767 . . . . 0.0 112.328 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.448 ' HA ' HG21 ' B' ' 708' ' ' VAL . 1.7 m -71.66 142.0 85.62 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-O 118.776 -0.63 . . . . 0.0 109.309 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -30.06 96.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 123.101 2.534 . . . . 0.0 113.195 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.48 18.5 2.25 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.492 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.838 0.827 . . . . 0.0 109.647 -179.115 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.997 0.904 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -69.19 -26.47 64.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.143 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -64.71 -36.99 86.08 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.472 ' O ' HD12 ' C' ' 746' ' ' ILE . 42.6 ptt85 -74.34 -38.57 63.22 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.27 -37.47 75.05 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.941 -1.099 . . . . 0.0 109.337 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -71.43 -37.04 71.48 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.885 0.374 . . . . 0.0 110.475 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 18.9 p -67.94 -35.28 78.15 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.831 -0.543 . . . . 0.0 111.243 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.472 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -59.5 -22.2 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -59.47 -30.05 68.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.507 HD21 ' CG ' ' A' ' 714' ' ' PRO . 0.2 OUTLIER -61.74 -16.35 48.58 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.539 178.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 44.5 t -55.53 -54.47 25.2 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.783 ' HB2' HD23 ' B' ' 785' ' ' LEU . 1.6 m-80 -72.53 -24.64 61.17 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 122.223 1.011 . . . . 0.0 108.547 174.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -20.13 32.54 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.996 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 42.7 m -58.44 -40.71 83.32 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 117.546 0.673 . . . . 0.0 109.332 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 22.6 tp -62.85 -51.14 68.16 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -58.91 -34.4 71.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.713 0.768 . . . . 0.0 111.28 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.478 ' C ' HD23 ' C' ' 755' ' ' LEU . 10.0 tt -58.56 -45.25 89.35 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.489 -176.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . 0.431 HG22 HD12 ' C' ' 760' ' ' LEU . 2.3 mp -69.73 -29.54 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.68 -31.64 69.8 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -55.43 -47.17 76.38 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.937 -1.102 . . . . 0.0 109.622 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.59 -45.27 65.67 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . 0.431 HD12 HG22 ' C' ' 756' ' ' ILE . 14.0 mt -66.32 -45.98 78.47 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -66.61 -49.64 65.66 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 23.0 p -67.51 -40.89 85.14 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.68 -0.637 . . . . 0.0 111.042 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -54.47 15.97 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.4 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -97.75 -49.37 4.85 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.304 -0.873 . . . . 0.0 112.331 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 6.5 tp 78.17 83.62 0.07 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 122.088 0.947 . . . . 0.0 111.042 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.17 -81.01 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.389 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 16.8 p -86.5 165.97 15.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.529 -0.732 . . . . 0.0 111.683 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -28.52 29.46 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -52.88 -37.16 60.14 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.964 0.888 . . . . 0.0 108.932 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 71.4 mmt-85 -69.31 -30.9 69.06 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.628 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.4 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.6 tt -60.97 -35.35 76.56 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.738 -0.601 . . . . 0.0 109.961 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -57.34 -35.18 69.58 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -63.06 -42.08 99.6 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.663 HD13 HG22 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -63.25 -38.52 91.47 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-O 122.057 0.932 . . . . 0.0 109.104 177.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.465 ' O ' HG22 ' C' ' 778' ' ' VAL . 0.2 OUTLIER -58.11 -43.18 87.02 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.737 -0.602 . . . . 0.0 110.036 -179.396 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.13 -35.58 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.337 0.589 . . . . 0.0 110.737 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.663 HG22 HD13 ' C' ' 774' ' ' LEU . 2.7 tt -65.17 -37.59 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.158 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.659 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -63.39 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.323 -0.861 . . . . 0.0 110.642 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.801 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.6 m -64.42 -48.72 74.28 Favored 'General case' 0 C--N 1.344 0.331 0 O-C-N 121.833 -0.542 . . . . 0.0 112.085 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -31.56 71.74 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.389 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 19.6 mt -54.96 -36.15 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 122.215 -0.303 . . . . 0.0 110.649 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.801 HG22 ' O ' ' C' ' 779' ' ' THR . 23.0 m -52.87 -38.09 27.48 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 O-C-N 121.256 -0.902 . . . . 0.0 110.944 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.333 0.587 . . . . 0.0 111.188 178.8 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.489 ' CB ' HD23 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.689 0.757 . . . . 0.0 109.128 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 33.4 mt 59.52 106.75 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.978 0.894 . . . . 0.0 110.797 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 179.41 -178.62 0.37 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.18 -46.04 86.46 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 121.363 -0.836 . . . . 0.0 109.696 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.9 -33.02 73.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.463 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 -49.05 11.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 111.007 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -64.8 -40.72 95.7 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 110.685 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.12 62.58 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.703 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -29.98 64.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.17 0.51 . . . . 0.0 111.001 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -59.78 -36.78 77.38 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.057 -0.402 . . . . 0.0 110.898 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -59.71 -17.4 34.33 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.884 0.373 . . . . 0.0 111.384 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.68 -29.02 21.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.334 0.588 . . . . 0.0 110.661 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -59.9 -48.97 79.51 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.681 0.753 . . . . 0.0 110.576 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 60.25 40.03 18.39 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.892 0.853 . . . . 0.0 110.58 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -71.06 0.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.923 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.403 HD12 ' CE3' ' A' ' 678' ' ' TRP . 6.9 tp -68.25 -37.51 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 121.957 -0.464 . . . . 0.0 111.326 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.15 -35.73 49.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -64.71 -50.14 68.14 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.376 0.608 . . . . 0.0 110.568 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.568 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.7 t90 -65.53 -43.05 91.21 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.675 0.75 . . . . 0.0 109.997 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -35.62 81.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -102.82 -3.15 26.76 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -109.37 -5.61 15.77 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.346 0.975 . . . . 0.0 112.729 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 678' ' ' TRP . 10.7 pt -68.48 -36.13 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 110.779 179.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -53.26 -41.73 65.79 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.254 0.549 . . . . 0.0 110.047 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.478 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -76.8 -34.96 23.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 177.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.481 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.4 t80 -59.84 -38.93 83.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.169 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.671 HG21 HD12 ' B' ' 686' ' ' ILE . 1.4 mp -60.6 -45.58 97.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 86.3 mt -61.73 -39.55 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.481 HD12 ' HA ' ' A' ' 685' ' ' PHE . 94.5 mt -59.85 -37.73 73.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.982 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 693' ' ' ILE . 93.3 t -54.85 -40.04 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.49 83.48 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 16.4 m -62.14 -38.68 89.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.04 0.924 . . . . 0.0 109.606 177.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.29 -39.33 86.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.923 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.667 HG22 HG21 ' C' ' 693' ' ' ILE . 0.9 OUTLIER -65.7 -43.17 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-O 121.153 0.501 . . . . 0.0 110.39 -178.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.12 92.96 Favored Glycine 0 CA--C 1.535 1.321 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.1 tt -53.5 -38.7 63.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 122.278 1.037 . . . . 0.0 110.045 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -57.02 -28.82 62.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.091 0.956 . . . . 0.0 112.362 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 40.7 mt -59.51 -36.54 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 O-C-N 121.502 -0.749 . . . . 0.0 110.438 -176.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.797 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.5 p -66.49 -30.51 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.468 -0.77 . . . . 0.0 110.763 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -55.59 -28.53 55.61 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.547 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.4 -36.9 71.89 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.797 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.8 m -61.17 -36.6 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.533 -0.729 . . . . 0.0 109.578 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.9 tp -57.62 -37.64 73.61 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.995 -0.44 . . . . 0.0 110.429 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 16.0 m -62.24 -40.49 96.35 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.442 0.639 . . . . 0.0 109.997 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.426 HD13 HH22 ' A' ' 707' ' ' ARG . 0.4 OUTLIER -60.59 -43.17 97.68 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.449 HG22 HD12 ' A' ' 748' ' ' LEU . 78.4 t -64.71 -45.01 96.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 CA-C-O 121.858 0.837 . . . . 0.0 109.101 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.84 -36.2 80.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.876 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.426 HH22 HD13 ' A' ' 704' ' ' LEU . 2.1 tmm_? -65.71 -49.52 68.2 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.22 0.534 . . . . 0.0 111.668 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.423 HG23 ' NH2' ' A' ' 707' ' ' ARG . 1.0 OUTLIER -76.32 -44.06 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.921 0.867 . . . . 0.0 110.279 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -63.37 -22.09 66.67 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.449 ' NE2' HD21 ' C' ' 755' ' ' LEU . 2.4 mt-30 -92.85 -21.77 19.68 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.181 -0.949 . . . . 0.0 112.114 -178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 111.79 35.42 1.86 Allowed Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 71.97 -171.93 0.15 Allowed 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.28 1.038 . . . . 0.0 111.502 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 3.7 m -62.46 161.25 27.65 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.499 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -12.51 92.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 124.56 3.507 . . . . 0.0 115.692 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -106.83 -17.16 14.28 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.919 -179.533 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 78.8 p . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 122.292 1.044 . . . . 0.0 110.932 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-O 121.922 0.868 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -26.1 65.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.296 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -55.79 -6.79 0.24 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.22 -41.54 88.87 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.273 -0.892 . . . . 0.0 109.757 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.614 ' HA ' HD13 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -67.04 -45.19 78.2 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.143 0.497 . . . . 0.0 110.442 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -30.86 71.32 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.275 0.559 . . . . 0.0 110.651 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 13.1 p -67.53 -46.56 72.47 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.621 HG21 HD12 ' C' ' 781' ' ' ILE . 1.5 mt -61.46 -47.0 95.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.803 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.641 ' NE ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.91 -7.55 11.9 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 117.844 -1.543 . . . . 0.0 111.278 -177.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.475 HD23 ' HG3' ' B' ' 714' ' ' PRO . 0.2 OUTLIER -60.21 -14.82 19.61 Favored 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 171.092 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.604 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.291 1.6 t -53.06 -55.15 13.57 Favored 'Isoleucine or valine' 0 C--N 1.356 0.884 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 177.294 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.604 ' ND2' HG12 ' A' ' 749' ' ' VAL . 2.3 m-80 -73.32 -27.64 61.64 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.924 174.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.81 -19.59 29.56 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 89.0 p -57.49 -37.28 72.69 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.86 -48.09 82.11 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.66 -34.88 71.73 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.011 0.434 . . . . 0.0 110.54 177.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.85 -45.07 90.95 Favored 'General case' 0 C--N 1.345 0.397 0 O-C-N 121.981 -0.449 . . . . 0.0 111.412 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.54 -33.08 55.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.16 -30.14 68.31 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.374 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.472 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.0 m-20 -55.16 -45.75 75.7 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.43 -0.794 . . . . 0.0 109.846 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.94 -44.35 69.75 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.473 0.654 . . . . 0.0 111.237 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -37.48 87.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -67.51 -44.56 78.15 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.245 0.545 . . . . 0.0 111.796 -178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.6 t -64.88 -45.18 87.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.962 0.887 . . . . 0.0 111.499 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.686 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -64.58 -54.15 36.58 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -177.786 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . 0.462 ' OG ' HD12 ' A' ' 771' ' ' LEU . 1.4 m -98.45 -22.99 15.74 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 8.9 tp 77.07 -60.53 0.46 Allowed 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.733 -0.604 . . . . 0.0 109.886 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.96 -67.72 0.29 Allowed 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.019 -0.425 . . . . 0.0 111.108 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.0 m -93.27 155.07 17.65 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.036 0.446 . . . . 0.0 110.531 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.97 -40.27 94.74 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.029 0.442 . . . . 0.0 110.323 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -53.94 -39.22 65.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.885 0.85 . . . . 0.0 109.664 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -58.47 -29.87 66.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.777 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.525 HD11 HD23 ' A' ' 763' ' ' LEU . 10.5 tt -59.56 -36.1 75.54 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 109.964 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -57.14 -33.34 67.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.484 0.659 . . . . 0.0 109.524 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -62.83 -42.36 99.7 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.817 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 763' ' ' LEU . 11.4 tp -58.83 -38.36 78.5 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 121.181 0.515 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.95 -39.83 93.44 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.158 0.504 . . . . 0.0 111.895 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . 0.544 ' O ' HG22 ' A' ' 779' ' ' THR . 39.6 mt -75.11 -42.16 57.02 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.81 -0.556 . . . . 0.0 112.395 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.555 HD11 HD12 ' A' ' 774' ' ' LEU . 1.1 pt -68.78 -37.51 77.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.731 -178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 774' ' ' LEU . 27.5 m -58.48 -42.65 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.543 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.688 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.9 t -63.57 -35.38 80.31 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 121.59 -0.694 . . . . 0.0 111.292 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.91 73.14 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.017 0.437 . . . . 0.0 111.692 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.437 ' CB ' HG21 ' B' ' 746' ' ' ILE . 24.4 mm -57.23 -41.97 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.996 -0.44 . . . . 0.0 111.439 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.688 HG22 ' O ' ' A' ' 779' ' ' THR . 10.4 m -54.95 -38.82 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.741 -0.6 . . . . 0.0 110.702 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -59.87 -48.84 80.07 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.327 0.584 . . . . 0.0 111.086 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.18 -43.37 70.92 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.391 0 O-C-N 121.906 -0.496 . . . . 0.0 111.161 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.583 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.7 mm? 52.29 83.47 0.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.875 0.845 . . . . 0.0 110.539 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -150.79 157.81 43.39 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.685 0.755 . . . . 0.0 110.555 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.498 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.7 OUTLIER -47.0 -57.69 4.75 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 122.283 1.039 . . . . 0.0 111.559 -179.729 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.498 ' N ' HD23 ' B' ' 663' ' ' LEU . 12.3 m-20 -64.33 -28.92 70.04 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.437 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -71.62 -49.43 40.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.03 0.443 . . . . 0.0 110.401 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -61.95 -46.63 88.44 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.355 0.597 . . . . 0.0 110.518 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.36 -21.49 66.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.7 t -70.67 -32.9 70.34 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 111.038 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 669' ' ' LEU . 4.4 mm? -60.46 -31.53 70.52 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.402 0.62 . . . . 0.0 111.087 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -59.61 -21.11 59.93 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.185 0.516 . . . . 0.0 111.321 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -86.8 -26.8 23.92 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.16 0.505 . . . . 0.0 111.216 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -60.13 -48.44 81.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.419 0.628 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.2 t80 59.82 40.86 18.91 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 122.027 0.917 . . . . 0.0 110.817 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.61 -72.05 0.2 Allowed 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.856 -0.528 . . . . 0.0 110.687 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -68.42 -37.22 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 O-C-N 121.961 -0.462 . . . . 0.0 111.303 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -52.36 -33.96 45.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -69.02 -50.14 51.43 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.604 -0.685 . . . . 0.0 110.875 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.728 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.4 t90 -65.76 -44.26 86.4 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.824 0.821 . . . . 0.0 109.126 178.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.17 -35.89 81.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -95.9 -21.0 18.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -95.95 -5.27 41.72 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.285 -0.885 . . . . 0.0 112.17 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.728 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.3 pt -62.59 -36.65 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.721 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -53.04 -47.36 68.47 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.979 0.419 . . . . 0.0 110.62 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.474 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -66.57 -35.33 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.51 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.34 -31.12 70.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.957 179.475 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.671 HD12 HG21 ' A' ' 686' ' ' ILE . 19.2 mm -60.8 -44.72 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 109.856 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.34 -41.07 88.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.305 0.574 . . . . 0.0 109.502 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.11 -38.79 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 685' ' ' PHE . 54.0 t -57.63 -39.71 71.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . 0.429 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -64.64 -26.77 71.18 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.4 m -60.62 -46.6 89.66 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.587 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.91 -33.34 71.74 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -176.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.587 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.84 -41.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 -178.697 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.584 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.67 -34.3 88.08 Favored Glycine 0 CA--C 1.537 1.413 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.602 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.0 tt -59.72 -37.04 77.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.224 1.012 . . . . 0.0 110.506 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -55.93 -28.54 57.3 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.584 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.4 tt -58.63 -36.08 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 O-C-N 121.169 -0.957 . . . . 0.0 110.696 -176.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -54.52 -30.26 21.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 O-C-N 121.859 -0.526 . . . . 0.0 110.899 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -55.98 -30.0 61.1 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.729 -0.607 . . . . 0.0 110.389 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.42 -40.81 83.49 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.455 HG22 ' O ' ' B' ' 698' ' ' VAL . 1.3 m -69.35 -35.99 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tp -51.65 -37.76 51.81 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.815 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 43.0 m -62.82 -38.82 92.25 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.751 0.786 . . . . 0.0 109.948 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.454 HD22 ' NH1' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -62.13 -43.15 99.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.429 1.109 . . . . 0.0 108.801 178.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.581 HG22 HD11 ' B' ' 748' ' ' LEU . 57.6 t -67.67 -40.64 84.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.695 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' B' ' 710' ' ' GLN . 7.9 m-20 -62.4 -37.61 86.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.028 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.454 ' NH1' HD22 ' B' ' 704' ' ' LEU . 11.1 mtm105 -68.13 -44.31 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.152 0.977 . . . . 0.0 111.273 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.55 -45.35 33.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -65.88 -45.84 80.57 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 118.877 -1.129 . . . . 0.0 112.96 -175.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 0.9 OUTLIER -105.57 -24.16 12.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 -179.372 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.95 164.03 10.94 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -102.49 -61.58 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.5 p -65.55 158.81 72.01 Favored Pre-proline 0 N--CA 1.468 0.427 0 O-C-N 121.316 -0.865 . . . . 0.0 109.637 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.475 ' HG3' HD23 ' A' ' 748' ' ' LEU . 87.3 Cg_exo -29.32 118.59 0.05 OUTLIER 'Trans proline' 0 N--CA 1.496 1.676 0 C-N-CA 122.784 2.323 . . . . 0.0 112.981 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 758' ' ' ASP . 5.0 tt -83.65 -19.01 36.14 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 122.535 1.159 . . . . 0.0 111.282 -178.844 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 122.082 0.944 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 42.1 mtp85 -72.59 -25.87 61.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.254 -0.884 . . . . 0.0 113.201 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.13 -9.38 0.39 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -176.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 1.4 mtm105 -60.45 -37.62 81.54 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.406 -0.809 . . . . 0.0 110.175 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.22 -29.85 66.03 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.043 0.449 . . . . 0.0 109.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -49.39 43.44 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 121.532 0.682 . . . . 0.0 109.647 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -59.85 -33.92 72.44 Favored 'General case' 0 N--CA 1.46 0.068 0 O-C-N 122.026 -0.422 . . . . 0.0 110.214 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.437 HG21 ' CB ' ' A' ' 781' ' ' ILE . 1.5 mp -58.07 -22.02 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 31.8 ttt-85 -59.58 -17.32 31.89 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.581 HD11 HG22 ' B' ' 705' ' ' VAL . 7.2 tt -55.03 -27.04 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . 0.421 HG23 ' O ' ' B' ' 746' ' ' ILE . 94.7 t -55.05 -53.82 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.401 ' ND2' ' H ' ' B' ' 750' ' ' ASN . 3.5 m-80 -72.66 -24.32 61.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.331 -1.304 . . . . 0.0 109.837 175.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.54 37.81 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.242 -178.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 24.7 m -59.43 -38.7 81.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 117.857 0.828 . . . . 0.0 109.656 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 26.0 tp -69.54 -47.13 64.71 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.49 0.662 . . . . 0.0 110.179 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.59 -35.44 77.37 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.494 HD22 ' O ' ' B' ' 755' ' ' LEU . 1.7 tm? -59.51 -45.34 92.0 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.06 -0.4 . . . . 0.0 111.665 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.76 -36.81 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 121.377 0.608 . . . . 0.0 110.011 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.97 -30.59 69.05 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.483 ' OD2' HD23 ' C' ' 715' ' ' LEU . 85.7 m-20 -55.91 -49.75 72.59 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.04 -1.038 . . . . 0.0 109.934 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -70.8 -42.56 70.14 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.31 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.6 -45.98 70.54 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -65.36 -20.48 66.41 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . 0.472 ' O ' HD22 ' B' ' 774' ' ' LEU . 1.6 m -76.6 -45.64 29.37 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.768 -0.582 . . . . 0.0 111.326 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -54.87 14.42 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 5.3 t -98.97 -49.83 4.39 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.855 0.836 . . . . 0.0 112.294 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.3 tt 63.86 89.34 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.825 0.822 . . . . 0.0 109.384 -177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 13.1 t80 72.74 122.11 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.514 0.673 . . . . 0.0 111.222 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.0 m 57.82 164.26 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.316 0.579 . . . . 0.0 111.451 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -109.84 64.31 0.61 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.781 1.277 . . . . 0.0 110.395 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.25 -42.51 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 122.474 1.13 . . . . 0.0 108.115 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -55.94 -29.03 59.5 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.527 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.738 ' O ' HD23 ' B' ' 771' ' ' LEU . 6.4 tt -59.38 -31.09 68.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.247 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -43.02 99.59 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -68.99 -45.2 71.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.634 . . . . 0.0 109.807 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.507 HD21 ' CZ ' ' C' ' 742' ' ' ARG . 0.1 OUTLIER -60.34 -37.87 81.98 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.752 0.787 . . . . 0.0 109.998 178.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.686 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.7 tm? -58.03 -36.8 73.24 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.673 -0.642 . . . . 0.0 110.007 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.4 mt -71.78 -38.22 70.33 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.103 -0.373 . . . . 0.0 111.884 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . 0.5 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.4 pp -69.4 -37.45 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.52 -0.738 . . . . 0.0 109.877 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 83.5 t -60.53 -46.6 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.42 -0.8 . . . . 0.0 110.012 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.793 ' O ' HG22 ' B' ' 782' ' ' VAL . 2.6 t -63.85 -41.11 97.88 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.852 -0.53 . . . . 0.0 112.413 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.63 72.08 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.716 -0.615 . . . . 0.0 111.91 -178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.8 mt -57.88 -37.03 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 O-C-N 121.78 -0.575 . . . . 0.0 111.049 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 779' ' ' THR . 16.1 m -54.49 -38.14 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.301 -0.875 . . . . 0.0 110.012 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -64.33 -44.61 90.99 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.342 0.592 . . . . 0.0 110.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.08 -42.12 80.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.467 0.651 . . . . 0.0 111.253 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.505 HD23 ' ND2' ' C' ' 750' ' ' ASN . 8.2 tp -76.98 -20.29 56.27 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.245 0.545 . . . . 0.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -55.84 -28.21 52.12 Favored Glycine 0 CA--C 1.534 1.229 0 O-C-N 122.005 -0.435 . . . . 0.0 112.107 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.17 128.24 54.53 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.809 -0.818 . . . . 0.0 110.633 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.454 179.524 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.792 0.806 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.6 142.9 11.24 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -173.2 176.0 3.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.443 0.639 . . . . 0.0 110.975 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.489 HD23 ' CB ' ' A' ' 660' ' ' LEU . 2.5 tm? -52.94 -46.54 68.18 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 122.036 0.922 . . . . 0.0 110.943 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -64.53 -26.62 68.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.58 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -81.14 -42.38 20.99 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 110.412 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -60.71 -44.79 96.16 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.583 0.706 . . . . 0.0 110.613 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.71 -26.65 64.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.208 0.528 . . . . 0.0 111.646 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.4 t -61.33 -30.32 70.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.98 -0.45 . . . . 0.0 112.07 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.488 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.7 mm? -66.7 -39.51 88.11 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -59.8 -27.65 66.77 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.649 -0.657 . . . . 0.0 111.091 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -66.3 -32.86 74.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.292 0.567 . . . . 0.0 110.129 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -63.87 -40.93 97.7 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.792 0.806 . . . . 0.0 109.637 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.1 t80 62.16 12.24 4.93 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.978 0.732 . . . . 0.0 112.978 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -136.72 -59.94 0.71 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.566 -0.709 . . . . 0.0 112.592 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -63.41 -38.23 81.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.504 0.668 . . . . 0.0 110.731 -178.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.8 m -52.84 -38.57 61.61 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.173 0.511 . . . . 0.0 110.967 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -59.34 -49.05 79.3 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.622 0.725 . . . . 0.0 109.933 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.504 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -60.19 -43.4 95.92 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.167 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.21 -40.05 90.05 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -94.87 -10.04 32.5 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -94.6 -22.9 17.88 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.714 -0.616 . . . . 0.0 111.933 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.504 HG23 ' O ' ' C' ' 678' ' ' TRP . 13.4 pt -64.51 -36.9 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.93 -0.481 . . . . 0.0 110.738 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 7.5 ttt-85 -54.47 -47.22 73.22 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.488 ' O ' HD13 ' C' ' 688' ' ' ILE . 1.8 mp -64.67 -34.48 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.7 OUTLIER -60.34 -37.27 80.12 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.737 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.601 HD12 HG22 ' B' ' 686' ' ' ILE . 10.9 mm -61.08 -47.19 94.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.103 0.478 . . . . 0.0 109.749 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.04 -37.06 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.488 HD13 ' O ' ' C' ' 684' ' ' ILE . 1.2 mp -58.93 -38.87 75.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 65.4 t -58.55 -40.12 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.74 -36.29 65.17 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 12.1 m -67.31 -38.94 85.77 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.47 1.128 . . . . 0.0 110.222 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -46.49 89.16 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.425 -1.261 . . . . 0.0 114.053 -176.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.667 HG21 HG22 ' A' ' 693' ' ' ILE . 2.2 pp -59.91 -41.58 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 O-C-N 121.82 -0.55 . . . . 0.0 110.761 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.688 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.17 -37.06 92.33 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.97 -37.35 66.39 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.545 0.688 . . . . 0.0 109.955 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.552 HH22 HD12 ' B' ' 697' ' ' ILE . 25.4 mmt180 -56.71 -30.54 63.6 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.999 -0.438 . . . . 0.0 111.695 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.688 HG22 ' O ' ' C' ' 694' ' ' GLY . 13.4 tt -60.98 -36.89 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.8 t -67.13 -30.7 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.635 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -62.05 -30.99 71.36 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.108 0.48 . . . . 0.0 110.115 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.75 76.43 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -63.0 -39.71 86.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -37.98 87.46 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.677 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.0 m -62.82 -37.84 88.33 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.819 -0.551 . . . . 0.0 110.285 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.96 -41.71 98.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.813 0.816 . . . . 0.0 108.807 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.582 HG13 HD13 ' C' ' 748' ' ' LEU . 48.2 t -62.72 -44.67 99.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.266 1.031 . . . . 0.0 108.475 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -60.16 -35.6 75.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.117 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -47.95 83.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.707 0.765 . . . . 0.0 110.826 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -41.28 41.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.768 0.794 . . . . 0.0 110.769 -178.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -73.19 -33.6 65.51 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.684 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -102.29 -15.77 16.49 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 103.7 -173.06 21.54 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -132.22 -53.44 0.97 Allowed 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.544 -0.974 . . . . 0.0 112.749 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 8.4 m -93.94 146.5 31.78 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-O 118.28 -0.867 . . . . 0.0 109.641 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -31.31 93.56 0.01 OUTLIER 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.623 2.215 . . . . 0.0 112.811 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.483 HD23 ' OD2' ' B' ' 758' ' ' ASP . 17.2 tp -73.68 -10.42 59.67 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . 0.439 ' C ' ' O ' ' C' ' 715' ' ' LEU . 14.2 t . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 121.19 0.519 . . . . 0.0 112.29 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -26.43 62.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.51 -47.85 82.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.507 ' CZ ' HD21 ' B' ' 774' ' ' LEU . 24.3 ttp85 -63.88 -36.83 85.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -58.73 -34.14 71.01 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.029 1.286 . . . . 0.0 109.268 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -71.22 -32.73 69.14 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.489 0.662 . . . . 0.0 109.655 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 5.0 p -66.5 -47.31 73.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.92 0.39 . . . . 0.0 110.078 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.0 mp -53.98 -41.07 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 O-C-N 121.404 -0.81 . . . . 0.0 110.737 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -60.99 -16.13 39.61 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 118.372 -1.331 . . . . 0.0 110.417 -178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.582 HD13 HG13 ' C' ' 705' ' ' VAL . 0.9 OUTLIER -63.27 -19.26 64.41 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.362 176.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.0 t -55.21 -54.03 28.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.725 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.505 ' ND2' HD23 ' B' ' 785' ' ' LEU . 3.4 m-80 -72.53 -27.12 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.816 174.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.67 37.46 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.53 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 97.8 p -58.69 -38.82 79.07 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.038 -0.684 . . . . 0.0 109.356 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 20.8 tp -67.07 -49.02 66.46 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . 0.46 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.45 -35.42 74.02 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.644 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.532 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.9 tm? -59.65 -45.34 92.31 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.837 -0.539 . . . . 0.0 110.706 -178.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.35 -41.39 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.478 0.656 . . . . 0.0 109.266 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -68.4 -30.86 69.87 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.11 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -55.65 -49.48 72.77 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.347 -0.846 . . . . 0.0 110.009 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -71.12 -45.02 64.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.493 0.663 . . . . 0.0 111.049 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.44 -44.15 96.09 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -74.46 -47.5 33.11 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -177.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 79.3 p -67.34 -43.75 80.75 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.85 0.833 . . . . 0.0 111.196 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.417 ' HG ' HD22 ' C' ' 774' ' ' LEU . 8.7 tt -59.73 -53.22 60.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.636 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 34.3 m -96.79 -13.43 22.62 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 9.0 mt 57.27 67.69 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.954 0.883 . . . . 0.0 110.717 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 59.3 t80 79.07 -89.62 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 61.8 m -93.78 171.79 8.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.305 -0.872 . . . . 0.0 111.986 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.28 -33.61 67.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.224 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -54.4 -35.08 62.49 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.019 0.914 . . . . 0.0 108.812 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.25 -30.17 64.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.798 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -60.06 -35.13 74.47 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -33.9 67.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -41.36 98.85 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.486 HD11 HD11 ' A' ' 746' ' ' ILE . 6.7 tp -59.35 -38.98 81.76 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-O 121.142 0.496 . . . . 0.0 109.717 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.477 ' O ' HG12 ' C' ' 778' ' ' VAL . 1.8 mm? -58.91 -42.55 89.92 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.365 0.602 . . . . 0.0 110.729 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 35.8 mt -74.52 -37.21 63.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 109.668 178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.626 ' O ' HG13 ' C' ' 781' ' ' ILE . 71.4 mt -61.39 -49.06 86.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.123 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.477 HG12 ' O ' ' C' ' 775' ' ' LEU . 7.5 p -54.76 -39.18 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.753 ' O ' HG22 ' C' ' 782' ' ' VAL . 8.3 m -63.61 -43.16 97.69 Favored 'General case' 0 C--N 1.335 -0.052 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.679 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -31.86 72.02 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.626 HG13 ' O ' ' C' ' 777' ' ' ILE . 11.5 mt -56.48 -36.27 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.838 -0.539 . . . . 0.0 110.968 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.753 HG22 ' O ' ' C' ' 779' ' ' THR . 18.0 m -52.47 -37.86 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 121.432 -0.792 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 CA--C 1.553 1.07 0 O-C-N 121.452 -0.78 . . . . 0.0 111.465 -179.924 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.553 ' HB2' HD21 ' C' ' 663' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 120.312 0.101 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.7 mt 170.25 119.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.505 -0.747 . . . . 0.0 109.576 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.06 -174.16 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.73 -0.606 . . . . 0.0 109.881 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.547 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.6 OUTLIER -54.34 -40.07 67.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.562 0.696 . . . . 0.0 109.855 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . 0.434 ' N ' HD23 ' A' ' 663' ' ' LEU . 0.6 OUTLIER -69.8 -34.74 74.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.779 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -73.53 -44.58 57.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.44 0.638 . . . . 0.0 110.657 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -72.8 -46.26 54.17 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.185 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.97 -30.58 70.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.084 0.469 . . . . 0.0 111.658 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.0 m -65.22 -32.34 73.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.255 0.55 . . . . 0.0 111.005 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.7 -30.57 71.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.861 0.362 . . . . 0.0 111.565 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -59.45 -24.46 63.55 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.708 -0.62 . . . . 0.0 111.195 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -73.3 -22.34 60.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.085 0.469 . . . . 0.0 111.265 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.9 m95 -64.48 -45.28 88.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-O 121.154 0.502 . . . . 0.0 111.171 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . 0.427 ' CG ' ' O ' ' A' ' 673' ' ' PHE . 49.3 t80 60.67 10.03 2.43 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.394 0.616 . . . . 0.0 111.027 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -123.9 -66.94 0.96 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.988 -1.07 . . . . 0.0 111.269 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.98 -37.67 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 122.059 -0.401 . . . . 0.0 111.392 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.5 m -52.7 -38.6 60.93 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -61.79 -50.07 73.83 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 121.271 0.558 . . . . 0.0 110.433 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.61 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.3 t90 -65.52 -39.35 91.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.78 0.8 . . . . 0.0 109.654 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -35.93 81.83 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -104.98 -20.01 13.66 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -84.75 -14.46 48.19 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.282 -0.886 . . . . 0.0 111.84 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.61 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.0 pt -60.82 -35.8 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.243 0.544 . . . . 0.0 110.513 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 -53.06 -47.02 68.77 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.151 -0.343 . . . . 0.0 110.346 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -65.96 -32.01 56.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -62.79 -29.86 71.03 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.158 179.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.805 HD12 HG21 ' C' ' 686' ' ' ILE . 21.2 mm -60.72 -45.4 97.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.16 0.505 . . . . 0.0 110.188 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.8 mt -71.12 -37.65 67.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.138 0.494 . . . . 0.0 109.776 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.02 -37.66 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 122.053 -0.404 . . . . 0.0 110.174 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 685' ' ' PHE . 67.4 t -54.61 -39.91 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -58.87 -38.77 93.0 Favored Glycine 0 CA--C 1.533 1.178 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.0 m -64.46 -38.3 90.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.815 0.817 . . . . 0.0 109.63 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -45.5 91.48 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.772 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.638 HG13 HG22 ' B' ' 693' ' ' ILE . 0.2 OUTLIER -67.38 -40.96 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.721 -179.2 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . 0.487 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -60.78 -21.62 58.64 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 177.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.517 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -62.53 -37.61 86.77 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.813 0.816 . . . . 0.0 109.788 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 3.0 mmt180 -55.02 -28.4 51.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 694' ' ' GLY . 20.4 tt -59.2 -36.79 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 O-C-N 120.559 -1.338 . . . . 0.0 109.427 -177.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.745 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -67.38 -30.92 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-O 121.514 0.673 . . . . 0.0 110.038 177.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.2 m-85 -55.61 -28.53 55.72 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.334 0.588 . . . . 0.0 109.733 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.0 -36.91 70.95 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.745 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -62.19 -35.72 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 O-C-N 121.59 -0.694 . . . . 0.0 109.485 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.6 -39.21 87.31 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.029 -0.419 . . . . 0.0 110.205 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -62.62 -33.82 75.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.512 0.672 . . . . 0.0 109.854 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.1 OUTLIER -62.9 -43.13 99.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.402 1.096 . . . . 0.0 108.745 177.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.825 HG22 HD23 ' A' ' 748' ' ' LEU . 67.1 t -67.77 -45.21 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.201 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.42 -37.08 84.43 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.512 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.431 ' CZ ' ' HE ' ' B' ' 707' ' ' ARG . 34.4 ttm180 -60.19 -49.46 77.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.894 0.854 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -43.05 49.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.001 0.905 . . . . 0.0 109.423 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.1 -14.59 61.88 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -98.41 7.68 45.87 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.011 -1.056 . . . . 0.0 113.427 -178.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 81.38 12.33 82.17 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.886 -0.509 . . . . 0.0 112.374 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.411 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.6 OUTLIER 61.94 -123.24 0.76 Allowed 'General case' 0 CA--C 1.564 1.492 0 O-C-N 121.648 -0.913 . . . . 0.0 110.774 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.411 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 13.4 p -62.22 159.1 41.78 Favored Pre-proline 0 C--N 1.355 0.832 0 O-C-N 120.732 -1.23 . . . . 0.0 110.625 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.413 ' HG3' ' HG ' ' C' ' 748' ' ' LEU . 84.8 Cg_exo -44.59 109.04 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.68 1.587 . . . . 0.0 112.836 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.22 -19.1 13.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.512 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 14.4 p . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 122.565 1.174 . . . . 0.0 110.427 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.838 0.828 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -25.62 62.65 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.71 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.54 -13.28 0.91 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 69.3 mtm-85 -69.19 -46.68 66.86 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.458 -0.777 . . . . 0.0 109.255 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.77 -41.46 86.67 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.746 0.784 . . . . 0.0 110.267 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -35.47 76.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.444 -0.785 . . . . 0.0 111.192 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.33 -38.39 81.49 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.07 -0.394 . . . . 0.0 111.793 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.762 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.5 mp -64.2 -47.1 91.38 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.258 0 CA-C-O 116.566 -1.683 . . . . 0.0 113.923 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.411 ' C ' ' N ' ' A' ' 749' ' ' VAL . 0.2 OUTLIER -64.78 -11.22 34.36 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 122.471 2.396 . . . . 0.0 110.644 -176.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.825 HD23 HG22 ' A' ' 705' ' ' VAL . 57.5 tp -56.15 -14.93 3.05 Favored 'General case' 0 CA--C 1.562 1.429 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.273 1.5 t -53.75 -54.17 21.37 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.43 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.9 m-80 -72.36 -28.87 63.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 122.566 1.174 . . . . 0.0 108.289 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.661 ' HA3' HD12 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.32 Favored Glycine 0 C--N 1.339 0.726 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.181 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 79.8 p -57.36 -37.32 72.41 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.51 -47.49 85.38 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.13 -35.8 76.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.764 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.475 ' O ' HD23 ' A' ' 755' ' ' LEU . 6.7 tt -62.24 -45.34 93.76 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.292 0.568 . . . . 0.0 110.275 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . 0.412 HG22 HD12 ' A' ' 760' ' ' LEU . 52.8 mt -61.29 -36.88 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -69.45 -30.81 68.81 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.236 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.562 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 79.2 m-20 -57.9 -49.22 77.47 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.614 -0.679 . . . . 0.0 109.938 -178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -70.8 -43.42 68.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.019 0.528 . . . . 0.0 112.256 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.412 HD12 HG22 ' A' ' 756' ' ' ILE . 10.6 mt -68.73 -46.28 69.32 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 121.595 0.712 . . . . 0.0 112.565 -178.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -63.23 -25.4 68.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.292 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 61.6 p -74.3 -45.15 49.42 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.572 -0.705 . . . . 0.0 111.158 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.775 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -67.33 -55.52 13.49 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.092 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.43 -49.14 4.53 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.709 0.766 . . . . 0.0 112.173 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.476 ' C ' HD23 ' A' ' 765' ' ' LEU . 5.4 tt 82.98 -78.18 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.875 0.87 . . . . 0.0 111.644 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -109.99 -70.65 0.8 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.624 -0.672 . . . . 0.0 111.568 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.9 m -97.86 144.41 27.47 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.142 0.496 . . . . 0.0 110.604 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CE1' HD22 ' A' ' 771' ' ' LEU . 15.6 t80 -60.98 -29.54 69.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.997 0.427 . . . . 0.0 110.419 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -55.94 -36.65 68.0 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.882 0.849 . . . . 0.0 109.226 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.91 -29.6 60.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.671 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.69 HD11 HD23 ' A' ' 763' ' ' LEU . 29.5 tp -59.65 -43.53 93.87 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -59.53 -40.04 85.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.574 0.702 . . . . 0.0 109.394 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -68.0 -45.37 74.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.83 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 763' ' ' LEU . 0.2 OUTLIER -63.16 -38.41 91.05 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.392 0.615 . . . . 0.0 110.707 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.33 -39.88 88.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.9 -0.5 . . . . 0.0 111.168 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.9 mt -67.19 -40.64 86.55 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 17.8 pt -60.26 -36.93 71.69 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.56 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 35.2 t -55.59 -46.41 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.774 -0.579 . . . . 0.0 109.597 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.804 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.2 OUTLIER -63.92 -41.53 97.63 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.188 0.518 . . . . 0.0 110.856 179.358 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.87 72.49 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.44 -36.75 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 O-C-N 121.714 -0.616 . . . . 0.0 111.078 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 779' ' ' THR . 13.4 m -54.73 -40.26 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 O-C-N 121.471 -0.768 . . . . 0.0 111.46 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -65.28 -42.0 93.6 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.68 0.753 . . . . 0.0 111.178 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.9 tp -69.15 -38.79 78.95 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.327 0.584 . . . . 0.0 111.035 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.547 HD11 ' HG3' ' B' ' 747' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 120.871 0.367 . . . . 0.0 111.312 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.547 ' N ' HD12 ' A' ' 663' ' ' LEU . 3.0 tt . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.557 0.694 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.9 mp 61.02 103.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.575 0.702 . . . . 0.0 110.556 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -167.11 175.16 7.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.511 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.82 HD12 HD23 ' C' ' 660' ' ' LEU . 8.9 tt -53.59 -41.41 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.549 0.69 . . . . 0.0 110.363 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -73.31 -31.46 64.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.68 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -46.78 50.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.347 0.594 . . . . 0.0 110.777 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -64.38 -46.28 84.05 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.589 0.709 . . . . 0.0 110.394 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.37 -24.43 67.64 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.4 t -63.18 -35.01 78.89 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.229 0.537 . . . . 0.0 110.923 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.449 HD12 HG23 ' B' ' 675' ' ' ILE . 4.2 mm? -59.84 -28.12 67.22 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.211 0.529 . . . . 0.0 111.233 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -62.23 -23.53 66.71 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.048 0.452 . . . . 0.0 111.379 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -88.04 -26.6 22.49 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.238 0.542 . . . . 0.0 111.512 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -59.16 -49.11 79.12 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 111.014 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 59.3 41.34 20.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.799 0.809 . . . . 0.0 110.644 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -153.64 -71.33 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.802 -0.561 . . . . 0.0 111.224 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.465 HG13 HD23 ' B' ' 679' ' ' LEU . 6.5 tp -65.68 -37.21 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 O-C-N 121.869 -0.519 . . . . 0.0 111.344 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.26 -33.72 43.02 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -64.01 -49.88 70.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.439 0.638 . . . . 0.0 110.116 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.484 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.0 t90 -65.68 -39.86 91.75 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.828 0.823 . . . . 0.0 109.622 178.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.465 HD23 HG13 ' B' ' 675' ' ' ILE . 0.6 OUTLIER -66.12 -35.6 80.92 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.033 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -102.02 -31.2 10.77 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -68.81 -27.01 65.47 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.514 -0.741 . . . . 0.0 111.481 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.735 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.7 pp -60.42 -36.08 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 O-C-N 122.091 -0.381 . . . . 0.0 110.889 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . 0.735 ' N ' HD12 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -53.64 -47.23 70.51 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.281 0.563 . . . . 0.0 110.044 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.522 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.0 mp -76.06 -36.95 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -28.58 67.49 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.43 -44.78 96.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.54 -43.76 98.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.29 -37.86 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.433 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.407 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 42.4 t -55.81 -39.44 56.23 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -63.63 -27.46 71.02 Favored Glycine 0 CA--C 1.543 1.842 0 O-C-N 121.766 -0.584 . . . . 0.0 112.273 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 46.6 m -60.55 -44.55 96.0 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.624 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.43 -31.55 69.39 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 121.597 -0.69 . . . . 0.0 112.068 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.638 HG22 HG13 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -57.16 -44.69 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 O-C-N 121.438 -0.789 . . . . 0.0 109.237 -177.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.04 -32.07 80.94 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.442 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -55.54 -36.86 67.23 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.785 0.803 . . . . 0.0 109.89 178.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.1 mmt180 -54.67 -27.68 41.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.728 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.17 -36.02 55.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 O-C-N 120.85 -1.156 . . . . 0.0 109.325 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.442 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.0 p -61.78 -30.5 48.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 O-C-N 121.218 -0.926 . . . . 0.0 110.424 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 11.6 m-85 -56.62 -31.41 64.28 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.708 -0.62 . . . . 0.0 110.429 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.34 88.06 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.17 -38.78 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.13 -39.95 91.94 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.363 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -68.37 -33.59 74.54 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.579 0.704 . . . . 0.0 110.01 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -42.78 93.09 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.158 0.98 . . . . 0.0 108.956 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.16 -45.13 77.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 122.153 0.977 . . . . 0.0 109.176 178.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.53 -36.59 83.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.336 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.431 ' HE ' ' CZ ' ' A' ' 707' ' ' ARG . 18.3 ttm180 -62.07 -47.12 86.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.25 1.024 . . . . 0.0 109.485 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.6 t -70.28 -44.4 77.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.038 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.47 -44.97 95.34 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.562 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.4 pt20 -104.46 -24.46 13.04 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.11 176.18 14.35 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' A' ' 704' ' ' LEU . 0.9 OUTLIER -96.03 -65.05 1.0 Allowed 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.727 -0.867 . . . . 0.0 111.596 -179.224 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 42.9 p -69.48 159.61 82.82 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.353 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.594 ' HG3' HD13 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -31.63 142.3 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.361 2.041 . . . . 0.0 113.152 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.479 ' O ' HD23 ' B' ' 715' ' ' LEU . 8.3 tt -95.2 -18.9 20.5 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 715' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 122.326 1.06 . . . . 0.0 112.505 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.464 0.65 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -57.99 -26.32 62.2 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.332 0.587 . . . . 0.0 112.369 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -52.34 63.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.62 ' NH2' HD11 ' A' ' 774' ' ' LEU . 9.9 ptt85 -77.72 -34.47 52.66 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -45.06 90.6 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.093 -1.004 . . . . 0.0 108.809 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -71.46 -34.05 69.87 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.283 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 4.3 p -57.28 -38.29 73.7 Favored 'General case' 0 C--N 1.344 0.342 0 O-C-N 122.075 -0.391 . . . . 0.0 110.601 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.412 ' O ' HG23 ' B' ' 749' ' ' VAL . 28.5 mt -54.1 -19.87 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.553 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.547 ' HG3' HD11 ' A' ' 785' ' ' LEU . 3.0 ttt85 -59.85 -29.68 68.45 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.69 -18.67 8.57 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 122.109 -0.37 . . . . 0.0 110.063 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . 0.412 HG23 ' O ' ' B' ' 746' ' ' ILE . 43.9 t -56.04 -54.53 26.09 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 177.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.469 ' ND2' HD22 ' A' ' 785' ' ' LEU . 4.3 m-80 -73.07 -22.11 60.66 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.27 174.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.9 -19.84 31.21 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.228 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 6.9 m -58.25 -37.47 74.99 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.799 -0.824 . . . . 0.0 108.968 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.4 tp -66.01 -51.02 62.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.299 0.571 . . . . 0.0 109.757 178.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.37 -36.38 83.83 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.42 HD21 ' NE2' ' C' ' 710' ' ' GLN . 6.0 tt -59.96 -45.0 94.07 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.854 -0.529 . . . . 0.0 111.005 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -65.14 -34.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.711 0.767 . . . . 0.0 109.032 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.5 -30.29 68.11 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.724 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.402 ' OD1' HD22 ' C' ' 715' ' ' LEU . 37.9 m-20 -55.33 -47.96 74.89 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.323 -0.861 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.35 -45.25 66.49 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.105 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.4 mt -66.73 -46.5 75.28 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . 0.407 ' O ' ' HA ' ' B' ' 765' ' ' LEU . 26.5 mtm180 -66.65 -22.76 66.1 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 11.8 t -76.82 -45.1 29.9 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.521 0.677 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.856 ' HA ' HD22 ' B' ' 774' ' ' LEU . 5.1 mp -66.77 -54.6 21.11 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -178.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . 0.554 ' C ' HD12 ' B' ' 765' ' ' LEU . 12.9 p -98.56 -23.39 15.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . 0.554 HD12 ' C ' ' B' ' 764' ' ' SER . 5.2 mp 70.37 -66.9 0.26 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 121.731 -0.606 . . . . 0.0 110.996 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -130.22 -67.06 0.75 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.783 -0.573 . . . . 0.0 110.997 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 7.3 m -97.66 146.44 25.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.332 0.587 . . . . 0.0 110.739 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.98 -31.96 70.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.939 0.4 . . . . 0.0 110.599 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -53.67 -39.08 64.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.822 0.82 . . . . 0.0 109.542 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.57 -29.65 64.62 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.279 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.432 ' O ' HD23 ' B' ' 771' ' ' LEU . 5.7 tt -59.5 -43.26 93.38 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -37.27 75.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.67 -48.74 75.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.856 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.1 OUTLIER -58.83 -38.12 77.95 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 121.82 0.819 . . . . 0.0 110.05 178.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.693 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -58.28 -36.66 73.62 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 121.784 -0.573 . . . . 0.0 110.507 -179.096 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . 0.42 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.32 -31.28 67.23 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 22.5 pt -70.27 -36.69 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 121.471 -0.768 . . . . 0.0 109.792 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 39.2 t -55.53 -46.04 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 121.666 -0.646 . . . . 0.0 111.15 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.42 HG22 ' O ' ' B' ' 776' ' ' LEU . 12.4 t -63.31 -42.67 99.04 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.997 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -37.41 81.54 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.573 -0.705 . . . . 0.0 111.15 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.92 -47.14 94.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 122.05 -0.406 . . . . 0.0 111.32 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.1 -38.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.488 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.17 -46.03 89.45 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.721 0.772 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 31.2 tp -68.7 -40.55 79.98 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.975 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.465 HD23 ' CG ' ' C' ' 750' ' ' ASN . 1.3 tp -78.01 -16.79 57.8 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.98 0.419 . . . . 0.0 111.787 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -49.3 -37.46 24.76 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 -106.12 122.55 46.41 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 122.179 -0.601 . . . . 0.0 110.641 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.67 -179.747 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.82 HD23 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.418 0.628 . . . . 0.0 109.578 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.0 mp -132.13 158.19 42.3 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.391 0.615 . . . . 0.0 111.056 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.66 166.04 2.13 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.664 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.5 tm? -58.37 -48.52 80.35 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.924 0.869 . . . . 0.0 110.089 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.22 -21.82 66.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.52 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -41.44 22.0 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -61.63 -46.45 89.75 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.533 0.682 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.82 -31.91 68.9 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.616 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -57.87 -38.13 75.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.47 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -61.31 -29.31 69.8 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.066 0.46 . . . . 0.0 111.764 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 41.7 m95 -59.53 -28.87 67.46 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.965 -0.46 . . . . 0.0 111.198 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -77.68 -25.1 49.27 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 122.013 -0.43 . . . . 0.0 111.748 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.22 -42.22 90.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.426 0.631 . . . . 0.0 110.579 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.2 t80 53.58 30.97 11.63 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.098 0.475 . . . . 0.0 111.833 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -151.46 -69.85 0.17 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.508 -0.745 . . . . 0.0 112.471 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.62 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -68.31 -37.19 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.474 0.654 . . . . 0.0 111.515 -178.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -51.93 -33.72 38.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.462 -178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -57.08 -49.02 77.14 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.628 0.727 . . . . 0.0 109.576 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.604 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.8 t90 -64.78 -44.22 90.68 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 122.004 -0.435 . . . . 0.0 110.416 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.15 -36.1 82.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -98.11 -15.42 19.97 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -98.44 -11.92 21.87 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.329 -0.857 . . . . 0.0 112.295 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.604 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.1 pt -61.06 -36.4 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 121.788 -0.57 . . . . 0.0 110.872 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -53.45 -47.32 69.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.962 0.41 . . . . 0.0 110.132 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.453 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.9 -34.05 67.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.488 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.79 -33.37 71.63 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.335 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.805 HG21 HD12 ' A' ' 686' ' ' ILE . 11.6 mm -60.64 -46.74 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.31 -39.55 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.8 -37.12 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.429 HG23 ' O ' ' C' ' 685' ' ' PHE . 78.4 t -54.38 -39.74 45.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.2 -38.98 80.04 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.3 m -67.41 -38.47 84.68 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 122.237 1.018 . . . . 0.0 109.421 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.0 tp -59.74 -46.17 89.95 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.261 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -67.84 -41.61 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.044 -0.41 . . . . 0.0 111.105 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.692 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.34 -29.85 69.91 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.597 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.4 tt -63.01 -37.6 87.83 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 122.005 0.907 . . . . 0.0 110.25 178.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -55.75 -28.4 55.74 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.692 HG22 ' O ' ' C' ' 694' ' ' GLY . 20.2 tt -58.61 -35.51 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.426 -0.796 . . . . 0.0 111.532 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.597 HG12 ' O ' ' C' ' 695' ' ' LEU . 11.0 p -53.97 -29.94 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.469 -0.769 . . . . 0.0 110.103 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -55.99 -31.5 63.09 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.808 -0.558 . . . . 0.0 110.336 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.47 -37.68 78.84 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.13 -39.28 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.87 -37.22 86.0 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.022 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 52.6 p -62.9 -36.14 82.39 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.761 -0.587 . . . . 0.0 110.621 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -40.49 93.94 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 108.832 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.27 -43.75 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -62.38 -35.66 79.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.364 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -59.52 -51.03 71.61 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.969 0.89 . . . . 0.0 110.355 -178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -45.56 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.925 0.869 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -73.81 -38.09 64.69 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.42 ' NE2' HD21 ' B' ' 755' ' ' LEU . 10.2 tt0 -102.63 -2.52 28.19 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 86.45 -176.13 48.03 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -139.19 -57.96 0.6 Allowed 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.585 -0.95 . . . . 0.0 112.548 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 14.9 p -81.41 149.17 64.63 Favored Pre-proline 0 C--N 1.338 0.103 0 CA-C-O 118.335 -0.84 . . . . 0.0 109.644 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -30.64 94.64 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.429 2.086 . . . . 0.0 112.566 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.402 HD22 ' OD1' ' B' ' 758' ' ' ASP . 0.5 OUTLIER -81.52 16.78 1.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.305 -176.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 121.806 0.812 . . . . 0.0 110.34 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 121.66 0.743 . . . . 0.0 111.546 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -72.14 -26.68 62.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.848 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -61.56 -8.26 4.16 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.855 -0.528 . . . . 0.0 112.395 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.542 ' NE ' HD11 ' B' ' 774' ' ' LEU . 63.7 mtm-85 -71.76 -45.27 62.21 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.724 -0.61 . . . . 0.0 111.677 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.4 -38.62 77.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.877 -0.515 . . . . 0.0 109.796 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.12 -42.47 69.18 Favored 'General case' 0 N--CA 1.457 -0.084 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.2 p -58.35 -43.09 88.17 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 122.088 -0.383 . . . . 0.0 110.935 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.3 -21.03 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 O-C-N 121.667 -0.645 . . . . 0.0 109.448 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -59.74 -26.3 65.54 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 109.097 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.482 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.0 OUTLIER -55.5 -24.25 30.48 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.861 0.362 . . . . 0.0 110.104 178.553 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.66 -54.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.35 0.627 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.465 ' CG ' HD23 ' B' ' 785' ' ' LEU . 3.0 m-80 -72.3 -24.93 61.4 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.892 0.853 . . . . 0.0 109.19 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.33 -20.75 37.89 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.905 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 1.9 m -58.81 -37.92 77.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.921 0.86 . . . . 0.0 109.775 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 19.1 tp -67.04 -51.42 55.0 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.479 0.657 . . . . 0.0 109.935 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.93 -34.84 78.88 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.413 0.625 . . . . 0.0 111.828 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.36 -45.11 92.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.101 0.477 . . . . 0.0 110.867 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.04 -34.83 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.517 0.675 . . . . 0.0 109.427 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.26 -30.76 68.94 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -55.76 -49.07 74.11 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 121.033 -1.042 . . . . 0.0 109.987 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -70.47 -44.77 67.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.448 0.642 . . . . 0.0 111.648 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -40.92 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -78.85 -35.57 43.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 15.4 p -64.54 -45.39 87.38 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.628 -0.67 . . . . 0.0 111.276 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -55.79 10.85 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.1 m -99.28 -49.53 4.43 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.419 -0.801 . . . . 0.0 112.67 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 8.7 tp 80.31 106.26 0.07 Allowed 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.884 0.849 . . . . 0.0 110.348 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 70.65 -68.26 0.22 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.64 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 3.3 m -144.47 179.66 7.12 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.356 0.598 . . . . 0.0 111.518 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.5 -162.32 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 11.1 t60 75.78 -59.81 0.51 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -61.96 -30.2 70.76 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.568 177.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.77 -32.59 70.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -35.09 68.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -69.45 -34.47 74.46 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.579 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.3 OUTLIER -58.74 -38.04 77.52 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.004 178.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.99 -37.01 73.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.648 0.737 . . . . 0.0 109.666 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.12 -38.99 60.88 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.643 0.735 . . . . 0.0 109.584 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.566 HG22 ' CD1' ' C' ' 781' ' ' ILE . 82.7 mt -59.06 -45.47 92.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.853 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 31.1 m -58.54 -44.11 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.313 -0.867 . . . . 0.0 111.42 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.419 ' O ' HG22 ' C' ' 782' ' ' VAL . 82.3 p -63.89 -46.19 85.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -31.76 72.11 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.133 0.492 . . . . 0.0 111.576 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.762 HG21 ' HB ' ' A' ' 746' ' ' ILE . 58.7 mt -63.89 -47.1 92.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.24 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.419 HG22 ' O ' ' C' ' 779' ' ' THR . 33.1 m -54.09 -37.89 36.46 Favored 'Isoleucine or valine' 0 C--N 1.35 0.625 0 CA-C-N 119.72 1.145 . . . . 0.0 110.047 -177.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 . . . . . 0 CA--C 1.543 0.677 0 CA-C-O 121.413 0.625 . . . . 0.0 110.767 178.494 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt -177.08 101.52 0.05 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.543 0.687 . . . . 0.0 109.676 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -173.65 -169.17 0.48 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.165 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.4 tt -48.02 -39.53 20.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.379 0.609 . . . . 0.0 110.821 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.48 -37.08 71.34 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -41.73 51.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.558 0.694 . . . . 0.0 110.739 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -75.15 -45.76 38.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.842 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.17 -35.28 76.13 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.021 0.439 . . . . 0.0 111.907 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.0 m -64.17 -31.03 72.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.526 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.418 HD23 HG23 ' A' ' 676' ' ' THR . 12.4 tp -63.42 -31.14 72.22 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.977 -0.452 . . . . 0.0 111.698 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -59.73 -29.84 68.41 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.778 -0.576 . . . . 0.0 111.08 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -25.57 68.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.183 0.516 . . . . 0.0 111.168 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -60.99 -40.54 93.86 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.59 0.71 . . . . 0.0 110.278 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 23.8 t80 56.34 35.01 25.15 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.559 0.695 . . . . 0.0 111.235 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -155.41 -64.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.714 -0.617 . . . . 0.0 111.649 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 679' ' ' LEU . 8.1 tp -68.22 -37.28 77.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 122.061 -0.399 . . . . 0.0 111.568 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.418 HG23 HD23 ' A' ' 669' ' ' LEU . 5.0 m -52.56 -33.69 46.91 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 122.095 -0.378 . . . . 0.0 111.727 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -65.88 -49.76 66.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.299 0.571 . . . . 0.0 110.686 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.4 t90 -65.26 -44.6 87.57 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.509 0.671 . . . . 0.0 109.352 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 675' ' ' ILE . 3.2 mm? -65.35 -35.61 81.48 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.964 -0.46 . . . . 0.0 111.729 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -93.28 -14.97 26.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -93.37 -12.95 28.73 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.608 -0.682 . . . . 0.0 111.787 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.1 pp -60.79 -36.57 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 O-C-N 121.872 -0.517 . . . . 0.0 110.442 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.474 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.3 ttt-85 -53.77 -47.43 70.74 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.613 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.498 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -73.84 -35.12 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.421 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.4 OUTLIER -58.75 -27.78 65.26 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.612 -177.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.964 HG21 HD12 ' B' ' 686' ' ' ILE . 14.9 mm -60.88 -42.09 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 121.513 0.673 . . . . 0.0 109.247 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 77.2 mt -71.04 -36.75 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.072 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 684' ' ' ILE . 30.8 mm -58.6 -37.31 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 O-C-N 122.043 -0.411 . . . . 0.0 109.996 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 685' ' ' PHE . 98.8 t -54.44 -42.01 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.76 -41.51 66.46 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -65.92 -38.71 89.39 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.834 0.826 . . . . 0.0 109.714 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -45.86 91.16 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.947 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.808 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -67.76 -42.0 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.785 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.42 -24.57 61.74 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.563 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -60.47 -39.22 86.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.014 0.911 . . . . 0.0 109.459 178.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 17.6 mmt180 -56.22 -28.44 58.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.889 0.875 . . . . 0.0 112.812 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.1 -37.21 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 O-C-N 121.17 -0.956 . . . . 0.0 108.67 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.733 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.8 p -67.69 -30.65 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 O-C-N 121.533 -0.729 . . . . 0.0 110.239 176.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.89 -28.99 59.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.071 0.463 . . . . 0.0 110.405 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.47 -37.0 72.2 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.0 m -63.58 -35.99 74.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 119.938 -0.705 . . . . 0.0 109.552 178.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.8 tp -61.01 -42.3 98.2 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.013 -0.429 . . . . 0.0 110.753 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 60.9 p -62.94 -35.02 78.72 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.371 0.605 . . . . 0.0 110.072 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.44 96.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 122.113 0.958 . . . . 0.0 108.852 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 701' ' ' VAL . 98.6 t -65.39 -45.11 94.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.029 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -62.91 -36.82 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.914 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.425 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 8.3 ttm180 -60.59 -47.5 85.94 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.43 0.633 . . . . 0.0 110.612 -178.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 748' ' ' LEU . 1.2 t -75.02 -44.37 44.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 122.188 0.995 . . . . 0.0 108.58 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -66.11 -18.71 65.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.973 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -97.22 -18.82 19.0 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.384 -0.823 . . . . 0.0 112.841 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 116.66 11.27 9.53 Favored Glycine 0 CA--C 1.54 1.601 0 O-C-N 121.385 -0.822 . . . . 0.0 112.751 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.455 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 63.32 -121.08 0.56 Allowed 'General case' 0 CA--C 1.565 1.521 0 O-C-N 121.935 -0.744 . . . . 0.0 111.053 179.322 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.455 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 69.7 p -62.77 159.35 45.22 Favored Pre-proline 0 C--N 1.351 0.672 0 O-C-N 120.84 -1.163 . . . . 0.0 111.519 -178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.485 ' HD2' HG21 ' C' ' 708' ' ' VAL . 83.0 Cg_exo -43.67 113.72 0.43 Allowed 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 121.758 1.639 . . . . 0.0 111.758 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.12 -20.27 13.06 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.483 1.225 0 CA-C-O 122.669 1.223 . . . . 0.0 110.876 -179.037 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 122.18 0.99 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 12.4 mtt-85 -58.03 -25.47 61.2 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.759 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -10.8 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.502 ' O ' HD12 ' A' ' 746' ' ' ILE . 7.1 mtm105 -70.71 -46.18 63.56 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.45 -0.782 . . . . 0.0 109.196 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -59.07 -46.1 89.14 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.191 0.52 . . . . 0.0 111.962 -178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.41 -28.61 63.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.57 0.7 . . . . 0.0 111.67 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 12.2 p -69.51 -36.46 76.47 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.011 -1.056 . . . . 0.0 111.726 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.9 mp -66.61 -46.79 85.2 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 CA-C-O 117.058 -1.449 . . . . 0.0 114.0 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -13.09 59.41 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 122.715 2.507 . . . . 0.0 109.453 -179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.631 HD13 ' HG3' ' B' ' 714' ' ' PRO . 56.5 tp -60.1 -17.23 38.4 Favored 'General case' 0 C--N 1.363 1.187 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 172.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.3 p -57.63 -44.82 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.432 ' ND2' HG12 ' A' ' 749' ' ' VAL . 5.9 m-80 -70.9 -13.19 61.93 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 122.116 0.96 . . . . 0.0 109.447 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.11 -18.95 21.66 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 124.167 0.889 . . . . 0.0 111.329 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 70.6 p -57.38 -37.3 72.45 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 117.645 0.722 . . . . 0.0 109.06 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.93 -51.05 69.67 Favored 'General case' 0 C--N 1.346 0.414 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.86 -35.25 72.66 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.892 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.3 -44.99 92.49 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -61.71 -36.21 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.02 -30.56 70.68 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.625 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.533 ' OD1' HD22 ' B' ' 715' ' ' LEU . 13.2 m-20 -56.09 -50.15 71.83 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.407 -0.808 . . . . 0.0 109.154 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -71.49 -45.15 63.27 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.686 0.755 . . . . 0.0 111.624 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.457 ' O ' HD23 ' A' ' 760' ' ' LEU . 1.4 tt -61.53 -38.99 89.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.652 0.739 . . . . 0.0 112.359 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 13.5 ttm105 -82.59 -17.98 42.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 15.9 p -76.23 -46.16 29.48 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.481 -0.762 . . . . 0.0 112.706 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -68.6 -54.37 16.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.19 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 5.1 t -97.86 -49.51 4.78 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.039 0.923 . . . . 0.0 111.556 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 765' ' ' LEU . 7.9 tt 75.77 -71.3 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.298 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -108.4 -66.31 1.05 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.724 -0.61 . . . . 0.0 111.238 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 2.0 t -104.92 134.3 48.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.076 0.465 . . . . 0.0 110.476 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.451 ' CZ ' HD13 ' A' ' 771' ' ' LEU . 2.8 t80 -55.27 -21.63 15.25 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.981 0.419 . . . . 0.0 110.821 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -60.5 -39.92 89.46 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-O 121.726 0.774 . . . . 0.0 109.24 178.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -55.69 -29.5 59.52 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.837 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.501 HD11 HD22 ' A' ' 763' ' ' LEU . 9.2 tt -59.44 -34.77 72.92 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 122.157 -0.339 . . . . 0.0 110.606 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -56.88 -32.92 66.35 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -66.13 -46.84 76.13 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.572 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.5 tp -58.91 -38.65 79.4 Favored 'General case' 0 C--N 1.354 0.782 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.441 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . 0.446 ' O ' HD23 ' A' ' 775' ' ' LEU . 7.5 tt -63.38 -42.6 98.83 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.692 -0.63 . . . . 0.0 111.791 -178.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 43.9 mt -74.57 -39.64 62.13 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.71 -37.44 77.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.427 -178.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 18.4 m -60.4 -42.86 92.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.571 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.028 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.808 ' O ' HG22 ' A' ' 782' ' ' VAL . 24.2 p -63.79 -44.67 92.68 Favored 'General case' 0 C--N 1.343 0.303 0 O-C-N 122.042 -0.412 . . . . 0.0 111.768 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -33.69 76.13 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.44 ' HB ' HG21 ' B' ' 746' ' ' ILE . 60.6 mt -54.97 -37.1 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 O-C-N 121.911 -0.493 . . . . 0.0 110.663 -179.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 779' ' ' THR . 14.6 m -54.76 -38.15 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 O-C-N 121.209 -0.932 . . . . 0.0 109.69 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.16 -45.36 92.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.555 0.693 . . . . 0.0 110.753 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.89 -43.88 86.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.236 0.541 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.417 HD21 ' HG2' ' B' ' 747' ' ' ARG . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.531 0 CA-C-O 120.921 0.391 . . . . 0.0 111.509 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.461 ' O ' HD22 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 120.457 0.17 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.461 HD22 ' O ' ' B' ' 660' ' ' LEU . 0.0 OUTLIER 176.53 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -176.01 -179.35 1.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.634 0.731 . . . . 0.0 110.924 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.51 HD12 ' HG ' ' C' ' 660' ' ' LEU . 0.5 OUTLIER -56.58 -39.05 72.84 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.498 0.666 . . . . 0.0 109.837 179.474 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.12 -34.22 77.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.344 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -75.22 -47.12 29.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.087 0.47 . . . . 0.0 110.379 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.424 ' HE1' HD12 ' B' ' 661' ' ' LEU . 82.6 m95 -68.24 -46.0 71.69 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.501 0.667 . . . . 0.0 111.439 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.64 -19.21 65.82 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.045 -178.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.8 66.24 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.063 -0.398 . . . . 0.0 111.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.443 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -60.78 -36.32 78.68 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -59.9 -17.26 35.83 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.846 -0.534 . . . . 0.0 111.239 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -27.17 24.79 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.16 0.505 . . . . 0.0 110.205 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -64.04 -46.62 83.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.545 0.688 . . . . 0.0 110.431 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 21.0 t80 57.65 31.84 20.97 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.517 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -142.93 -70.41 0.33 Allowed 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.719 -0.613 . . . . 0.0 110.907 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.95 -37.5 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.05 -0.406 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.5 -33.87 46.92 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -65.67 -50.32 65.37 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.712 -0.617 . . . . 0.0 110.701 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.686 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.8 t90 -65.76 -42.45 90.88 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 122.017 0.913 . . . . 0.0 109.76 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -39.17 93.8 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.14 -178.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -97.15 -28.2 14.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -77.11 -15.59 59.5 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.468 -0.77 . . . . 0.0 111.901 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.686 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.9 pt -60.78 -37.35 75.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.894 -0.504 . . . . 0.0 111.006 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -53.66 -47.35 70.45 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.912 0.387 . . . . 0.0 110.805 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.495 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -70.64 -35.17 59.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.97 -27.89 67.2 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.205 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.964 HD12 HG21 ' A' ' 686' ' ' ILE . 18.1 mm -60.62 -48.2 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 O-C-N 121.827 -0.546 . . . . 0.0 109.789 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -64.88 -41.1 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.99 -38.06 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.22 -44.3 98.94 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.18 -26.7 9.5 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 13.7 m -60.52 -46.11 91.37 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.541 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.82 -32.89 71.07 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.364 -0.835 . . . . 0.0 112.504 -177.558 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.541 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -58.99 -47.02 91.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.96 -27.21 66.66 Favored Glycine 0 CA--C 1.541 1.699 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.565 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -59.33 -37.25 77.34 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.04 0.924 . . . . 0.0 110.089 179.455 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.808 ' HE ' HD11 ' A' ' 693' ' ' ILE . 12.8 mmt180 -55.39 -27.85 50.3 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -179.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.74 -36.86 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 O-C-N 121.028 -1.045 . . . . 0.0 109.01 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.565 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.6 p -67.41 -30.69 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 O-C-N 121.722 -0.611 . . . . 0.0 110.327 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.0 m-85 -56.49 -31.26 63.89 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.871 -0.518 . . . . 0.0 110.153 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.61 78.7 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -37.73 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.665 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.5 tp -56.86 -37.92 71.99 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.761 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 51.0 m -62.83 -36.15 82.25 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.18 0.514 . . . . 0.0 110.837 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -44.85 90.34 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 122.238 1.018 . . . . 0.0 108.826 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.691 HG22 HD13 ' B' ' 748' ' ' LEU . 76.9 t -65.36 -45.14 94.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 122.522 1.153 . . . . 0.0 109.211 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -62.69 -35.87 81.08 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.557 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -65.74 -49.41 68.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.488 0.661 . . . . 0.0 112.323 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -44.17 31.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.25 -45.35 91.43 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -175.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.43 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 2.4 pt20 -104.67 -24.56 12.94 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.67 177.31 14.84 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -113.43 -62.68 1.56 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.736 -0.861 . . . . 0.0 112.804 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 8.4 p -62.76 159.3 45.5 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.388 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.631 ' HG3' HD13 ' A' ' 748' ' ' LEU . 86.5 Cg_exo -29.81 108.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 122.76 2.307 . . . . 0.0 112.961 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.533 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.9 tt -67.02 -16.72 64.54 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 121.763 0.792 . . . . 0.0 109.547 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.488 0.661 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -58.6 -26.86 64.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.167 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -55.72 -12.28 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -68.41 -40.97 81.08 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.563 -0.711 . . . . 0.0 111.567 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -58.5 -41.14 84.69 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.506 -0.746 . . . . 0.0 110.664 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.26 -36.96 71.95 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.244 0.545 . . . . 0.0 110.021 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 8.9 p -56.96 -46.22 82.31 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 122.056 -0.402 . . . . 0.0 110.44 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.44 HG21 ' HB ' ' A' ' 781' ' ' ILE . 1.8 mp -53.34 -19.22 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.081 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.417 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.0 OUTLIER -59.39 -28.13 66.61 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.126 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.691 HD13 HG22 ' B' ' 705' ' ' VAL . 4.2 pp -55.61 -21.29 16.94 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.941 0.401 . . . . 0.0 110.374 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 48.4 t -55.61 -53.95 31.11 Favored 'Isoleucine or valine' 0 C--N 1.35 0.596 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.428 ' H ' HD22 ' B' ' 750' ' ' ASN . 3.5 m-80 -72.61 -22.66 60.93 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.689 174.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.23 -20.68 36.85 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.999 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 18.4 m -59.5 -38.97 82.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 117.884 0.842 . . . . 0.0 109.631 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 16.9 tp -67.89 -51.18 51.0 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.436 0.636 . . . . 0.0 109.995 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.55 81.0 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.3 0.571 . . . . 0.0 111.513 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.538 HD21 ' NE2' ' C' ' 710' ' ' GLN . 5.7 tt -60.81 -45.49 94.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.903 0.382 . . . . 0.0 111.618 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 54.8 mt -65.64 -37.32 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 121.654 0.74 . . . . 0.0 109.229 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.13 -30.06 68.24 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.673 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.509 ' OD1' HD22 ' C' ' 715' ' ' LEU . 82.7 m-20 -55.35 -46.91 76.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.531 -0.731 . . . . 0.0 109.767 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.36 -45.23 66.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-O 121.063 0.458 . . . . 0.0 112.166 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 43.4 mt -69.2 -45.35 70.13 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.475 0.655 . . . . 0.0 112.748 -178.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -60.86 -43.19 98.7 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.8 m -59.69 -42.97 94.16 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.413 -0.805 . . . . 0.0 111.323 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -68.0 -54.23 20.01 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.81 -48.11 5.32 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.653 0.739 . . . . 0.0 112.051 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 78.21 -54.74 0.49 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.654 0.782 . . . . 0.0 111.343 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -137.51 119.46 15.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 111.236 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 16.7 m 54.02 177.3 0.02 OUTLIER 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.147 0.499 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . 0.461 ' CD1' HD13 ' B' ' 771' ' ' LEU . 4.9 m-85 -97.49 -2.11 42.67 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.958 -0.464 . . . . 0.0 111.621 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -74.3 -43.15 57.99 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -62.24 -29.96 70.76 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.262 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' B' ' 768' ' ' TYR . 0.2 OUTLIER -59.79 -31.08 69.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -56.94 -35.61 69.28 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.466 0.651 . . . . 0.0 109.425 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -69.02 -34.93 76.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.311 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.502 HD13 ' HG ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.45 -37.95 76.51 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.023 0.439 . . . . 0.0 110.576 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.34 -36.54 73.58 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 0.0 111.65 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.35 -48.09 71.37 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.775 -0.578 . . . . 0.0 111.623 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 17.4 pt -56.35 -34.94 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 O-C-N 122.004 -0.435 . . . . 0.0 110.4 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.432 ' HA ' HG12 ' B' ' 781' ' ' ILE . 56.2 t -53.44 -43.16 51.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -178.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.06 -36.49 84.18 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.75 0.786 . . . . 0.0 110.22 177.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -63.33 -36.43 83.65 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.155 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.968 HG23 HG23 ' C' ' 746' ' ' ILE . 3.7 mm -54.79 -55.45 15.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 O-C-N 122.11 -0.369 . . . . 0.0 110.933 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 31.3 m -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.39 0.614 . . . . 0.0 110.355 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.98 -42.05 99.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.196 0.522 . . . . 0.0 111.474 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 12.1 tp -68.66 -39.43 80.64 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.956 0.884 . . . . 0.0 110.226 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.727 HD13 HD21 ' C' ' 750' ' ' ASN . 0.8 OUTLIER -76.99 -23.0 52.29 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.459 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.58 -54.62 8.74 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.32 125.4 37.9 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.402 0.62 . . . . 0.0 110.323 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.632 -179.474 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.641 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.385 0.612 . . . . 0.0 110.016 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.517 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.1 mp 56.84 102.71 0.02 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 121.587 0.708 . . . . 0.0 110.585 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -164.13 171.07 15.57 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.717 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.466 HD23 ' C ' ' C' ' 663' ' ' LEU . 10.5 tt -51.93 -61.93 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.588 0.708 . . . . 0.0 110.853 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.81 -16.61 63.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.279 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -81.22 -46.15 15.25 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 122.06 -0.4 . . . . 0.0 111.194 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -64.84 -45.98 83.82 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.667 0.746 . . . . 0.0 110.013 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.32 -21.21 66.25 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.431 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 48.4 t -69.63 -29.69 67.24 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.884 -0.51 . . . . 0.0 111.483 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' C' ' 669' ' ' LEU . 4.4 mm? -59.85 -37.66 79.91 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.129 0.49 . . . . 0.0 110.795 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -59.87 -18.94 48.29 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 111.297 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -81.21 -28.33 34.94 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.425 0.631 . . . . 0.0 110.777 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -60.05 -46.51 89.3 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.586 0.708 . . . . 0.0 110.209 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.23 36.62 27.62 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.428 0.632 . . . . 0.0 111.66 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.6 -73.36 0.14 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.734 -0.604 . . . . 0.0 111.772 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.688 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.1 -37.33 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.366 0.603 . . . . 0.0 111.608 -178.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.76 -33.72 36.23 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.918 -0.488 . . . . 0.0 111.983 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -60.63 -50.19 74.52 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.721 -0.612 . . . . 0.0 109.665 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.5 t90 -65.67 -40.08 92.02 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 121.761 0.791 . . . . 0.0 109.815 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.548 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -65.44 -35.78 81.93 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -104.91 -20.52 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -176.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -86.97 -12.94 46.04 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.48 -0.763 . . . . 0.0 112.159 -179.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.1 pp -60.75 -36.35 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 122.033 -0.417 . . . . 0.0 110.329 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.499 ' N ' HD12 ' C' ' 682' ' ' ILE . 8.4 ttt-85 -53.9 -47.1 71.48 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.934 0.397 . . . . 0.0 110.467 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.445 HG22 HD12 ' C' ' 688' ' ' ILE . 1.7 mp -66.34 -36.35 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.676 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.8 -33.73 72.12 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.955 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.77 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.95 -52.01 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.074 0.464 . . . . 0.0 110.083 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 61.3 mt -62.84 -37.07 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 121.709 0.766 . . . . 0.0 108.934 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.445 HD12 HG22 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -58.82 -37.57 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.676 HG23 ' O ' ' C' ' 685' ' ' PHE . 61.7 t -55.16 -40.03 53.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . 0.417 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.65 -39.49 75.86 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -67.66 -38.77 84.23 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.976 0.893 . . . . 0.0 109.384 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -46.33 90.2 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.224 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.533 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.3 pp -65.27 -41.91 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 121.353 0.596 . . . . 0.0 109.848 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.556 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.76 -25.9 64.3 Favored Glycine 0 CA--C 1.539 1.588 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.42 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.4 tt -58.38 -37.8 75.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.723 0.773 . . . . 0.0 110.271 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -55.44 -28.71 56.02 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.556 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.79 -36.44 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 120.874 -1.141 . . . . 0.0 111.804 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.42 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -59.1 -30.39 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.271 -0.893 . . . . 0.0 110.19 178.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -56.41 -30.71 63.11 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.839 -0.538 . . . . 0.0 110.18 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.81 -37.78 77.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -44.33 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.97 -36.95 75.7 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.72 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 66.6 m -62.05 -37.26 84.29 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -40.91 95.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 122.0 0.905 . . . . 0.0 108.779 178.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.528 HG13 HD13 ' C' ' 748' ' ' LEU . 96.7 t -65.69 -44.98 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.693 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -62.79 -36.29 82.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.49 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.58 -48.69 78.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.8 0.81 . . . . 0.0 110.296 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.485 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -76.0 -43.96 38.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.978 -178.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . 0.414 ' HB2' HD22 ' C' ' 748' ' ' LEU . 4.5 tmm_? -73.07 -36.23 66.82 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.482 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.538 ' NE2' HD21 ' B' ' 755' ' ' LEU . 8.4 tt0 -102.48 -7.66 21.72 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 99.83 166.29 29.34 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -110.83 -63.0 1.45 Allowed 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.715 -0.874 . . . . 0.0 111.681 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 76.3 p -90.57 159.62 40.73 Favored Pre-proline 0 C--O 1.234 0.273 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.209 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_exo -38.93 119.32 0.43 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.561 1.508 . . . . 0.0 111.801 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.509 HD22 ' OD1' ' B' ' 758' ' ' ASP . 3.0 tt -96.47 4.52 52.05 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -175.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.928 0.87 . . . . 0.0 112.047 -179.449 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 . . . . . 0 C--O 1.234 0.274 0 CA-C-O 122.172 0.987 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -65.67 -26.71 67.91 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.584 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -55.98 -15.21 3.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.495 ' O ' HD12 ' C' ' 746' ' ' ILE . 45.6 mtm-85 -56.06 -33.45 65.02 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.82 -0.55 . . . . 0.0 110.8 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -58.28 -40.25 81.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.618 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -47.83 54.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.058 0.456 . . . . 0.0 110.455 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' C' ' 742' ' ' ARG . 2.3 p -57.01 -34.88 68.6 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.968 HG23 HG23 ' B' ' 781' ' ' ILE . 0.3 OUTLIER -52.85 -23.23 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 O-C-N 121.658 -0.651 . . . . 0.0 109.856 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -60.18 -24.35 64.69 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.553 0.692 . . . . 0.0 110.069 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.528 HD13 HG13 ' C' ' 705' ' ' VAL . 3.0 pp -61.37 -26.34 67.77 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.904 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 82.3 t -55.81 -53.91 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.727 HD21 HD13 ' B' ' 785' ' ' LEU . 4.7 m-80 -72.69 -22.84 60.84 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.588 175.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -22.88 46.66 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.906 -177.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 38.1 t -61.2 -41.2 96.41 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.832 -0.805 . . . . 0.0 109.543 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.9 tp -68.12 -46.23 71.48 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 109.938 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.98 -35.56 81.1 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.689 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.483 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.2 tt -60.0 -45.43 92.76 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.268 0.556 . . . . 0.0 110.72 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 45.5 mm -67.43 -40.95 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.138 0.97 . . . . 0.0 108.723 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.44 -30.34 71.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.529 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -55.24 -44.0 75.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.552 -0.717 . . . . 0.0 110.892 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.13 -45.12 67.5 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.309 0.576 . . . . 0.0 110.891 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 26.9 mt -67.26 -40.22 86.2 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -67.29 -50.63 59.55 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 1.3 m -68.35 -43.3 77.74 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.228 1.013 . . . . 0.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.55 -52.68 56.41 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.96 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.79 -34.02 11.04 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.127 -0.983 . . . . 0.0 113.418 -177.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.03 177.25 0.24 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -38.14 -66.3 0.27 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 30.9 m -97.17 162.01 13.55 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.853 -0.529 . . . . 0.0 110.649 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.29 -29.7 62.9 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.839 0.352 . . . . 0.0 110.676 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -53.83 -32.04 51.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.815 0.817 . . . . 0.0 109.471 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 -69.91 -30.54 67.97 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.04 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.4 -43.39 96.73 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -56.78 -36.97 70.47 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.494 0.664 . . . . 0.0 109.428 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -69.17 -39.42 78.75 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.23 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.411 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -65.12 -38.11 89.61 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 121.087 0.47 . . . . 0.0 110.855 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.429 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.7 mp -58.4 -37.79 76.02 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.269 0.557 . . . . 0.0 110.256 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 57.4 mt -74.81 -36.72 62.45 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.486 0.66 . . . . 0.0 110.06 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.445 HG22 ' CD1' ' C' ' 781' ' ' ILE . 40.2 mt -61.26 -47.88 91.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.719 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.446 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -56.06 -39.33 57.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 O-C-N 121.641 -0.662 . . . . 0.0 111.182 -178.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.685 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.2 m -61.01 -47.95 84.08 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.402 -0.811 . . . . 0.0 110.978 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -68.23 -36.53 79.64 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.809 -0.557 . . . . 0.0 111.535 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.445 ' CD1' HG22 ' C' ' 777' ' ' ILE . 72.9 mt -54.93 -38.23 44.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 CA-C-O 118.644 -0.693 . . . . 0.0 111.954 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.685 HG22 ' O ' ' C' ' 779' ' ' THR . 14.2 m -53.2 -36.79 26.26 Favored 'Isoleucine or valine' 0 C--N 1.354 0.787 0 CA-C-N 120.169 1.35 . . . . 0.0 109.092 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 . . . . . 0 CA--C 1.553 1.088 0 O-C-N 121.344 -0.848 . . . . 0.0 110.688 178.282 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.525 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 37.4 mt 61.46 113.23 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.598 0.713 . . . . 0.0 110.306 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -177.55 179.11 0.96 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.75 -41.81 67.51 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.365 0.603 . . . . 0.0 110.367 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -73.71 -32.87 64.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -78.01 -44.36 26.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.135 0.493 . . . . 0.0 111.199 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -65.04 -45.3 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.189 0.518 . . . . 0.0 110.475 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.35 -20.91 65.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.223 0.535 . . . . 0.0 111.362 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.8 t -65.17 -39.4 92.88 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.0 mm? -59.89 -27.69 66.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.039 0.447 . . . . 0.0 111.873 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.0 m95 -60.18 -24.6 64.9 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.822 -0.549 . . . . 0.0 112.132 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.61 -15.59 39.3 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.651 -0.655 . . . . 0.0 111.861 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -65.66 -45.98 80.89 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.497 0.665 . . . . 0.0 110.378 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 45.9 t80 58.42 42.49 21.16 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -161.02 -69.28 0.06 Allowed 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.653 -0.654 . . . . 0.0 111.733 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.33 -36.7 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 122.095 -0.378 . . . . 0.0 111.923 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 6.9 m -52.04 -34.5 43.6 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -65.83 -50.07 65.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.381 0.61 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -65.72 -44.13 86.99 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.698 0.761 . . . . 0.0 110.345 178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -36.0 82.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -95.51 -42.82 8.26 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -70.69 -3.71 19.9 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.557 -0.715 . . . . 0.0 112.755 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.732 HD12 ' H ' ' A' ' 683' ' ' ARG . 1.1 pp -60.91 -36.66 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.672 -0.642 . . . . 0.0 110.038 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.732 ' H ' HD12 ' A' ' 682' ' ' ILE . 9.7 ttt-85 -56.99 -47.13 81.53 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.177 0.513 . . . . 0.0 110.478 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.462 ' O ' HD13 ' A' ' 688' ' ' ILE . 1.8 mp -70.59 -33.2 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -28.48 69.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.584 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 17.0 mm -60.95 -48.07 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.292 0.568 . . . . 0.0 109.656 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 80.1 mt -60.36 -36.94 72.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.462 HD13 ' O ' ' A' ' 684' ' ' ILE . 1.4 mp -60.09 -38.35 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -55.21 -40.86 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.88 -33.27 77.74 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -66.73 -38.71 87.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.95 0.881 . . . . 0.0 110.998 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -46.03 90.69 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -61.43 -41.65 90.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 O-C-N 121.716 -0.615 . . . . 0.0 109.764 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.22 -39.76 97.62 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 178.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.478 ' O ' HG12 ' A' ' 698' ' ' VAL . 4.3 tt -62.43 -40.37 96.35 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.869 0.842 . . . . 0.0 109.7 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.711 ' HE ' HD11 ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.95 -28.08 55.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.66 0.784 . . . . 0.0 112.188 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.9 -34.8 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.551 -0.718 . . . . 0.0 109.41 -177.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.761 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.1 p -53.81 -29.1 17.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 O-C-N 121.534 -0.729 . . . . 0.0 110.307 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -54.77 -28.68 50.53 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.808 -0.558 . . . . 0.0 110.504 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -36.57 70.19 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.3 m -61.29 -35.83 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 CA-C-O 121.674 0.75 . . . . 0.0 109.474 177.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.74 -41.95 96.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.11 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 56.3 p -62.48 -31.92 72.74 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.641 0.734 . . . . 0.0 109.679 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.512 HD22 HH12 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.48 -47.14 87.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.662 1.22 . . . . 0.0 108.667 177.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.415 ' CG2' HD12 ' A' ' 748' ' ' LEU . 80.7 t -64.63 -45.15 96.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.363 -1.289 . . . . 0.0 109.29 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . 0.53 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 7.8 m120 -62.31 -36.98 83.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.512 HH12 HD22 ' A' ' 704' ' ' LEU . 38.3 ttm105 -57.57 -48.46 79.29 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.725 -1.235 . . . . 0.0 110.083 -179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.5 t -76.42 -44.45 35.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.404 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.98 -16.03 61.08 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 1.8 tt0 -101.26 -8.45 22.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.031 -1.043 . . . . 0.0 113.468 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.38 18.1 10.68 Favored Glycine 0 CA--C 1.541 1.664 0 O-C-N 121.824 -0.548 . . . . 0.0 112.55 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.417 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.3 OUTLIER 54.13 -125.03 2.27 Favored 'General case' 0 CA--C 1.566 1.567 0 O-C-N 121.831 -0.805 . . . . 0.0 110.243 179.281 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.417 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 0.3 OUTLIER -62.13 159.71 36.4 Favored Pre-proline 0 C--N 1.353 0.734 0 O-C-N 120.754 -1.216 . . . . 0.0 109.689 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -45.4 104.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 121.177 1.251 . . . . 0.0 111.56 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.24 -20.33 16.65 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -177.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.549 0.909 0 CA-C-O 122.24 1.019 . . . . 0.0 111.052 -179.769 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.708 0.766 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -57.84 -25.28 60.47 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.001 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -12.33 0.68 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -177.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -42.26 89.18 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.479 -0.763 . . . . 0.0 109.021 177.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' C' ' 781' ' ' ILE . 19.5 m-20 -64.91 -36.1 83.27 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -36.67 77.05 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.69 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.5 p -63.76 -45.3 90.46 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.66 HD12 ' CD1' ' C' ' 781' ' ' ILE . 40.7 mt -55.32 -21.11 8.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.973 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.544 ' NH1' HG22 ' C' ' 781' ' ' ILE . 1.9 mmp_? -59.86 -30.48 69.0 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.629 -0.669 . . . . 0.0 109.201 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.837 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -62.07 -16.69 53.96 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.167 0.508 . . . . 0.0 110.315 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.57 -55.12 16.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.885 0 O-C-N 120.96 -1.088 . . . . 0.0 108.123 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.411 HD22 ' H ' ' A' ' 750' ' ' ASN . 4.5 m-80 -72.96 -22.0 60.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 122.507 1.146 . . . . 0.0 108.953 174.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.45 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.72 -19.65 29.1 Favored Glycine 0 C--O 1.219 -0.843 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.211 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 88.3 p -57.98 -37.65 74.62 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.046 0.923 . . . . 0.0 109.065 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.2 tp -66.64 -51.1 60.02 Favored 'General case' 0 C--N 1.343 0.294 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.41 73.38 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.087 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.0 tt -58.67 -45.07 90.21 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.931 -0.481 . . . . 0.0 111.696 -176.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.73 -34.2 61.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.7 -29.48 66.9 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.941 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 20.2 m-20 -54.6 -49.02 71.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.324 -0.86 . . . . 0.0 109.686 -177.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.68 -44.93 65.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.527 0.679 . . . . 0.0 111.327 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 3.6 mt -65.74 -29.79 70.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 70.7 mtt180 -73.59 -27.79 61.48 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -45.74 39.43 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.368 -0.832 . . . . 0.0 110.446 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.706 ' HA ' HD22 ' A' ' 774' ' ' LEU . 6.3 mp -68.96 -54.94 12.62 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 -49.19 4.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.612 0.72 . . . . 0.0 111.785 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.422 ' C ' HD23 ' A' ' 765' ' ' LEU . 4.5 tt 79.21 -66.9 0.17 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.432 0.693 . . . . 0.0 110.988 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -112.64 -61.33 1.74 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.751 -0.593 . . . . 0.0 111.794 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 1.3 m -120.23 157.64 28.68 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.264 0.554 . . . . 0.0 110.732 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -21.16 66.06 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.769 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 65.0 m-70 -56.85 -42.0 78.94 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.307 1.051 . . . . 0.0 108.327 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -28.62 69.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.424 177.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.699 HD11 HD23 ' A' ' 763' ' ' LEU . 0.1 OUTLIER -58.5 -37.47 75.65 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.99 -32.89 72.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.21 -47.52 73.59 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 122.206 -0.309 . . . . 0.0 111.053 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 763' ' ' LEU . 6.1 tp -61.13 -37.8 84.12 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.977 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 25.6 mt -58.59 -36.41 73.96 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.83 -0.544 . . . . 0.0 112.045 -177.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 32.5 mt -74.55 -48.54 26.28 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.495 -0.753 . . . . 0.0 111.632 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.69 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.9 pp -70.69 -37.36 68.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 O-C-N 122.178 -0.326 . . . . 0.0 111.619 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.69 ' N ' HD12 ' A' ' 777' ' ' ILE . 9.8 p -58.71 -44.34 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 21.0 p -64.06 -35.56 81.15 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-O 122.223 1.011 . . . . 0.0 109.504 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -60.79 -45.42 94.45 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.481 HD12 ' HB ' ' B' ' 746' ' ' ILE . 2.7 pt -64.53 -41.94 93.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.108 -177.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.67 -38.6 82.69 Favored 'Isoleucine or valine' 0 C--N 1.346 0.451 0 CA-C-N 119.066 0.848 . . . . 0.0 111.025 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.41 -45.6 83.32 Favored 'General case' 0 C--N 1.35 0.588 0 O-C-N 121.715 -0.616 . . . . 0.0 111.031 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.42 ' O ' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -70.49 -40.21 73.72 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.382 -179.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.518 HD23 ' ND2' ' B' ' 750' ' ' ASN . 3.6 tp . . . . . 0 C--O 1.214 -0.792 0 O-C-N 122.06 -0.4 . . . . 0.0 110.861 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 54.74 96.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.554 0.692 . . . . 0.0 110.483 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -173.39 164.99 4.71 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.14 -37.64 67.22 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.471 0.653 . . . . 0.0 109.9 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -65.28 -36.92 85.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.699 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 10.9 tttm -80.63 -49.22 11.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.218 0.532 . . . . 0.0 110.125 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -56.53 -44.28 80.66 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.462 0.649 . . . . 0.0 110.029 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.66 -28.95 69.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.362 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 23.0 t -62.07 -36.82 82.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 111.242 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.467 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.8 mm? -59.78 -23.73 63.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 122.055 -0.403 . . . . 0.0 111.719 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -59.55 -29.0 67.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.32 0.581 . . . . 0.0 110.288 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.05 -7.71 56.62 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.212 0.53 . . . . 0.0 110.846 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . 0.44 ' O ' ' N ' ' B' ' 674' ' ' ASP . 14.4 m95 -94.54 34.64 1.29 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.333 0.587 . . . . 0.0 109.802 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -39.81 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 122.087 0.946 . . . . 0.0 113.35 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . 0.44 ' N ' ' O ' ' B' ' 672' ' ' TRP . 1.6 t70 177.7 -66.07 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.672 0.748 . . . . 0.0 110.134 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.69 -36.93 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.099 0.56 . . . . 0.0 112.022 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.4 m -51.6 -33.74 34.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -64.38 -50.02 69.33 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 121.744 -0.597 . . . . 0.0 109.884 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.633 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.64 -43.05 90.64 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.748 0.785 . . . . 0.0 109.52 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.72 80.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 15.4 t90 -100.48 -45.9 5.4 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -63.55 -7.21 6.47 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.594 -0.691 . . . . 0.0 112.398 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.8 pp -60.44 -36.43 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 O-C-N 121.652 -0.655 . . . . 0.0 110.418 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' B' ' 682' ' ' ILE . 8.2 ttt-85 -53.7 -47.35 70.59 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.048 -0.408 . . . . 0.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.482 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.1 mp -69.01 -36.05 71.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -31.41 69.75 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.607 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.763 HD12 HG21 ' A' ' 686' ' ' ILE . 14.1 mm -60.68 -46.56 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.74 -41.45 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.29 -37.74 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 53.5 t -59.11 -40.12 80.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.89 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.23 -27.22 67.16 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.752 -0.592 . . . . 0.0 111.822 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.0 m -60.66 -41.43 95.0 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -177.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.646 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.3 -33.2 70.8 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 121.486 -0.759 . . . . 0.0 112.372 -176.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.776 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -66.27 -40.38 86.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 121.453 -0.779 . . . . 0.0 109.896 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.504 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.89 -33.94 85.4 Favored Glycine 0 CA--C 1.543 1.807 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.415 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.9 tt -69.81 -37.22 76.18 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.866 0.841 . . . . 0.0 110.323 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.46 ' HE ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -55.08 -27.5 45.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.447 1.099 . . . . 0.0 113.832 -178.574 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.504 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.8 tt -57.71 -34.86 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.26 -0.9 . . . . 0.0 109.704 -177.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.415 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.2 p -53.52 -28.93 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 O-C-N 121.603 -0.686 . . . . 0.0 110.002 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -55.39 -30.7 60.89 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.612 -0.68 . . . . 0.0 109.993 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.77 78.0 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.5 -41.13 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.78 -37.78 80.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.303 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 44.1 p -62.47 -41.69 98.95 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.57 -178.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.85 -40.58 89.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.677 0.751 . . . . 0.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.34 -43.61 87.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -62.72 -36.58 83.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.348 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -65.65 -49.39 68.82 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.703 1.239 . . . . 0.0 109.49 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD11 ' B' ' 748' ' ' LEU . 9.4 t -77.4 -45.37 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -176.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -63.91 -44.81 91.83 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -174.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 7.9 pt20 -104.59 -24.14 13.03 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.95 165.11 10.13 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . 0.487 ' O ' HD11 ' A' ' 704' ' ' LEU . 24.5 p90 -106.7 -57.28 2.08 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.195 -0.591 . . . . 0.0 112.166 -179.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 65.7 p -74.83 159.16 83.68 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.313 -0.851 . . . . 0.0 108.792 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -32.89 124.5 0.11 Allowed 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.238 1.959 . . . . 0.0 112.376 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.431 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.6 tt -79.09 -14.93 58.84 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 121.945 0.878 . . . . 0.0 112.538 -178.798 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.628 0 CA-C-O 121.39 0.614 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -71.34 -26.5 62.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.105 0.479 . . . . 0.0 111.259 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.5 -10.58 0.67 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -56.13 -30.73 62.54 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.365 -0.834 . . . . 0.0 110.311 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.49 -41.66 97.6 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -37.17 72.21 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.567 178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . 0.495 ' O ' HD12 ' B' ' 748' ' ' LEU . 63.2 p -56.93 -36.0 69.73 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.481 ' HB ' HD12 ' A' ' 781' ' ' ILE . 1.2 mp -55.34 -18.3 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.405 HH11 HD11 ' A' ' 785' ' ' LEU . 14.9 ttm180 -59.48 -28.13 66.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.664 HD11 HG11 ' B' ' 708' ' ' VAL . 0.3 OUTLIER -55.54 -21.75 18.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.094 0.474 . . . . 0.0 109.856 177.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . 0.419 HG23 ' O ' ' B' ' 746' ' ' ILE . 54.1 t -55.84 -54.19 29.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.518 ' ND2' HD23 ' A' ' 785' ' ' LEU . 4.0 m-80 -72.94 -24.48 60.81 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.436 174.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.08 33.57 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.77 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.68 -37.94 77.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.001 0.901 . . . . 0.0 108.948 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.78 -49.4 58.95 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.4 0.619 . . . . 0.0 109.762 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.41 80.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.248 0.547 . . . . 0.0 112.359 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.4 tt -60.24 -45.53 92.93 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.425 0.631 . . . . 0.0 110.882 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.73 -39.29 85.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 122.004 0.907 . . . . 0.0 108.653 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.44 68.62 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.082 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 85.7 m-20 -55.15 -49.07 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.456 -0.777 . . . . 0.0 110.963 -177.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -70.3 -40.86 73.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.109 0.481 . . . . 0.0 110.809 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.1 mt -69.15 -31.06 69.47 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.6 -49.75 56.91 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.828 -0.545 . . . . 0.0 112.271 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 4.0 m -69.18 -41.07 77.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.743 0.782 . . . . 0.0 110.921 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.545 ' HA ' HD22 ' B' ' 774' ' ' LEU . 2.2 tp -59.99 -53.31 59.31 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.471 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . 0.425 ' HB2' HD12 ' B' ' 771' ' ' LEU . 23.1 t -97.35 -10.74 25.02 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.526 -0.734 . . . . 0.0 112.966 -178.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 mt 68.7 -73.47 0.09 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -138.76 -77.23 0.36 Allowed 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.864 -0.523 . . . . 0.0 110.08 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m -79.73 148.78 31.38 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.853 -0.529 . . . . 0.0 110.125 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -37.38 82.89 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.099 0.476 . . . . 0.0 110.122 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -54.46 -39.62 67.64 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.682 0.753 . . . . 0.0 109.494 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -59.49 -30.07 68.3 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.038 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 771' ' ' LEU . 3.8 tt -60.11 -38.41 82.91 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -40.52 85.19 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.23 -43.86 93.62 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.4 OUTLIER -59.51 -36.91 77.0 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 121.694 0.759 . . . . 0.0 110.539 178.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.85 -35.98 69.5 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.481 -0.762 . . . . 0.0 109.846 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . 0.45 ' O ' HG22 ' B' ' 779' ' ' THR . 70.8 mt -64.58 -37.65 88.28 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.85 -0.531 . . . . 0.0 110.797 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 9.9 pt -69.64 -35.49 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 O-C-N 121.63 -0.669 . . . . 0.0 109.393 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.407 ' HA ' HG12 ' B' ' 781' ' ' ILE . 72.6 t -54.04 -46.21 65.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 776' ' ' LEU . 4.8 t -64.02 -34.84 78.91 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.224 -0.922 . . . . 0.0 109.824 176.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -31.23 70.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 121.278 0.561 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.752 HD12 HG13 ' C' ' 746' ' ' ILE . 39.3 mm -54.35 -55.37 15.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.571 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.39 -38.75 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-O 121.655 0.741 . . . . 0.0 110.875 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.88 -41.87 95.27 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.745 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.37 -43.9 69.18 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.324 0.583 . . . . 0.0 111.285 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.844 HD23 ' ND2' ' C' ' 750' ' ' ASN . 5.4 tp -87.37 -9.37 55.0 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.63 -38.62 82.68 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.96 109.92 19.1 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 122.286 -0.538 . . . . 0.0 110.084 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.22 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.506 ' N ' HD23 ' C' ' 660' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.937 0 CA-C-O 120.419 0.152 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.409 HD22 ' CZ2' ' C' ' 666' ' ' TRP . 36.4 mt 56.04 99.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.48 0.657 . . . . 0.0 110.546 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.77 168.04 12.69 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.325 0.583 . . . . 0.0 110.236 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.525 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.3 tm? -43.58 -51.74 6.7 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.451 0.643 . . . . 0.0 112.232 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.481 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -71.9 -28.0 63.21 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -81.32 -32.27 33.15 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 122.05 -0.406 . . . . 0.0 111.496 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.409 ' CZ2' HD22 ' C' ' 661' ' ' LEU . 76.0 m95 -68.75 -46.35 69.05 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.236 0.541 . . . . 0.0 110.38 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.04 84.64 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.992 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -26.04 67.78 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.398 0.618 . . . . 0.0 110.63 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -34.37 74.21 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.16 0.505 . . . . 0.0 110.898 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -75.59 -14.57 60.39 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 122.13 -0.356 . . . . 0.0 111.749 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.64 -33.78 75.65 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.587 0.708 . . . . 0.0 110.334 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m0 -55.99 -40.09 72.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.595 0.712 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.54 43.25 23.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.78 0.8 . . . . 0.0 111.398 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -159.69 -65.52 0.07 Allowed 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.62 -0.675 . . . . 0.0 112.016 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.74 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -67.6 -38.24 80.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 121.444 0.64 . . . . 0.0 111.432 -178.593 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.2 m -52.94 -33.79 52.46 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -62.11 -50.05 73.46 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.817 -0.552 . . . . 0.0 111.69 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.656 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -65.41 -44.23 88.07 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.431 0.634 . . . . 0.0 109.389 178.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.523 ' O ' HD23 ' C' ' 679' ' ' LEU . 1.1 tt -64.28 -35.78 81.95 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.069 -178.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -95.93 -20.51 18.7 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.72 -19.18 29.54 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.714 -0.616 . . . . 0.0 111.648 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.656 HG23 ' O ' ' C' ' 678' ' ' TRP . 7.6 pt -60.66 -36.8 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 O-C-N 121.836 -0.54 . . . . 0.0 110.321 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -55.02 -47.15 75.11 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.172 0.51 . . . . 0.0 110.036 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.401 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -67.8 -33.87 64.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.52 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -60.17 -29.78 68.9 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.859 179.643 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 8.0 mm -64.42 -47.4 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.305 0.574 . . . . 0.0 109.708 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.3 mt -64.74 -39.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.92 -37.71 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.458 HG23 ' O ' ' C' ' 685' ' ' PHE . 56.0 t -54.8 -40.91 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.61 -41.32 64.79 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.0 m -66.73 -38.5 86.81 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.864 0.84 . . . . 0.0 109.497 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.35 -43.7 92.77 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.171 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.711 HD11 ' HE ' ' A' ' 696' ' ' ARG . 0.1 OUTLIER -68.5 -42.23 83.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.476 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.58 -34.14 84.75 Favored Glycine 0 CA--C 1.535 1.338 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.82 -36.93 63.04 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.322 1.058 . . . . 0.0 110.173 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.776 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.9 mmt180 -55.62 -28.59 56.1 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -177.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.476 HG22 ' O ' ' C' ' 694' ' ' GLY . 6.8 tp -59.27 -36.59 64.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 O-C-N 121.076 -1.015 . . . . 0.0 112.083 -175.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -56.51 -30.74 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.294 -0.879 . . . . 0.0 110.439 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -58.59 -31.75 68.33 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.8 -45.45 92.29 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.484 ' O ' HG23 ' C' ' 705' ' ' VAL . 1.8 t -65.93 -39.31 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.643 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.75 -37.68 87.53 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.78 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -68.37 -37.81 80.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.219 0.533 . . . . 0.0 110.596 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.39 -40.83 93.95 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.873 0.844 . . . . 0.0 108.955 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.484 HG23 ' O ' ' C' ' 701' ' ' VAL . 71.6 t -67.63 -45.57 84.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.981 0.896 . . . . 0.0 108.947 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 2.3 m120 -63.15 -36.49 83.78 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.418 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -49.57 74.16 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.551 0.691 . . . . 0.0 111.119 -177.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 4.2 p -77.19 -41.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.599 0.714 . . . . 0.0 112.453 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.7 -40.22 63.78 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 0.1 OUTLIER -101.93 -21.34 14.55 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -175.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.08 170.93 12.78 Favored Glycine 0 N--CA 1.474 1.169 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -131.79 -53.93 1.0 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.03 -0.688 . . . . 0.0 111.86 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.484 ' HA ' HG21 ' B' ' 708' ' ' VAL . 51.5 p -90.35 152.26 45.39 Favored Pre-proline 0 C--O 1.232 0.144 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.748 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -35.89 98.59 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.397 2.064 . . . . 0.0 111.63 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.3 16.21 0.64 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -176.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.472 0.651 0 CA-C-O 121.794 0.807 . . . . 0.0 110.017 178.856 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 122.271 1.034 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -62.32 -26.36 68.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.958 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.03 -19.31 6.7 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.754 -0.591 . . . . 0.0 111.815 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.482 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.4 mtm105 -66.25 -32.84 74.5 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.246 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.55 -37.28 72.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -71.28 -36.57 71.73 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.858 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.1 p -56.82 -25.29 55.59 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.13 -0.356 . . . . 0.0 110.522 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.752 HG13 HD12 ' B' ' 781' ' ' ILE . 0.7 OUTLIER -52.79 -32.42 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -23.3 62.85 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.265 0.555 . . . . 0.0 111.648 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 tt -72.19 -33.94 68.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.006 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.73 -54.03 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.8 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.844 ' ND2' HD23 ' B' ' 785' ' ' LEU . 6.9 m-80 -72.47 -13.89 61.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.759 0.79 . . . . 0.0 110.012 174.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.78 -20.83 41.66 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 121.973 -0.454 . . . . 0.0 112.71 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 2.4 m -58.85 -40.99 85.93 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 117.751 0.776 . . . . 0.0 109.839 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -68.59 -48.17 64.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.608 0.718 . . . . 0.0 109.557 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.1 -35.3 73.18 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.213 0.53 . . . . 0.0 111.291 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.53 ' C ' HD23 ' C' ' 755' ' ' LEU . 8.5 tt -59.65 -45.04 93.22 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.457 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.13 -40.69 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 109.818 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.26 -32.37 71.53 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.75 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -59.07 -39.26 81.55 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.533 -0.729 . . . . 0.0 109.124 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.41 -45.6 65.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.65 0.738 . . . . 0.0 111.509 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.41 -41.66 76.11 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.319 0.581 . . . . 0.0 112.564 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.41 -41.51 69.48 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.6 p -64.47 -45.48 87.19 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.427 HD22 HD11 ' C' ' 771' ' ' LEU . 0.2 OUTLIER -69.24 -55.0 11.84 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.683 -179.823 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.532 ' OG ' HD12 ' C' ' 771' ' ' LEU . 2.3 m -98.85 -43.46 6.74 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' C' ' 764' ' ' SER . 60.2 tp 85.71 -62.97 0.06 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.128 0.971 . . . . 0.0 110.36 -176.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.2 -74.13 0.46 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.486 -0.759 . . . . 0.0 111.887 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 68.2 m -106.58 159.47 16.16 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.734 -0.603 . . . . 0.0 111.125 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.35 -28.2 67.98 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 110.267 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -60.16 -40.6 90.48 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -30.74 69.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.286 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' OG ' ' C' ' 764' ' ' SER . 9.6 tt -60.3 -30.88 69.77 Favored 'General case' 0 C--N 1.344 0.366 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -39.27 73.93 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -65.51 -36.13 82.91 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.846 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.616 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -58.72 -37.91 77.18 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 121.489 0.662 . . . . 0.0 109.817 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.414 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.8 tp -57.45 -36.41 71.38 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.553 0.692 . . . . 0.0 109.431 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -36.14 64.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.405 0.621 . . . . 0.0 109.677 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 16.0 mt -62.07 -43.46 97.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.724 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.545 ' HA ' HD13 ' A' ' 746' ' ' ILE . 5.0 m -63.52 -45.92 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.917 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.491 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.4 p -64.11 -43.25 95.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.338 0.59 . . . . 0.0 112.109 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -32.15 72.78 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.021 -0.424 . . . . 0.0 112.075 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.66 ' CD1' HD12 ' A' ' 746' ' ' ILE . 79.5 mt -69.46 -43.78 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 O-C-N 121.801 -0.562 . . . . 0.0 111.607 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.491 HG22 ' O ' ' C' ' 779' ' ' THR . 26.8 m -56.06 -38.09 51.76 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 O-C-N 121.361 -0.837 . . . . 0.0 111.426 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 . . . . . 0 CA--C 1.544 0.737 0 O-C-N 121.435 -0.791 . . . . 0.0 111.331 -179.192 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.455 HD13 ' CD2' ' C' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt 55.62 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.538 0.685 . . . . 0.0 110.341 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -175.03 169.54 3.34 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.549 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.3 tt -50.85 -40.05 55.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -68.58 -36.28 78.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.407 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -81.13 -42.64 20.6 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.29 0.567 . . . . 0.0 110.343 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -64.34 -46.31 84.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.07 0.462 . . . . 0.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.96 76.75 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.42 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.4 m -59.72 -33.1 71.19 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.276 0.56 . . . . 0.0 110.833 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.408 HD23 HG23 ' A' ' 676' ' ' THR . 2.7 tp -60.53 -29.82 69.36 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.019 0.438 . . . . 0.0 111.092 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -60.67 -20.71 61.63 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.796 -0.565 . . . . 0.0 111.881 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -81.96 -23.99 35.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.08 0.467 . . . . 0.0 111.287 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -58.12 -43.43 87.22 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.496 0.665 . . . . 0.0 110.609 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.7 t80 56.78 37.5 28.85 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.45 0.643 . . . . 0.0 111.796 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.42 -68.23 0.08 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.633 -0.667 . . . . 0.0 112.026 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.653 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.87 -37.14 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-O 121.533 0.683 . . . . 0.0 111.532 -178.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.408 HG23 HD23 ' A' ' 669' ' ' LEU . 9.1 m -51.88 -33.73 37.91 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -62.73 -49.68 74.08 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.338 0.589 . . . . 0.0 109.8 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.814 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.9 t90 -65.07 -43.96 90.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.633 0.73 . . . . 0.0 109.553 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -35.41 80.14 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.003 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -99.92 -12.47 19.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -100.61 -1.3 35.73 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.475 -0.766 . . . . 0.0 111.814 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.9 pt -64.25 -36.75 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 O-C-N 121.918 -0.488 . . . . 0.0 110.822 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -47.28 69.84 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.376 0.608 . . . . 0.0 110.114 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.449 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.8 mp -66.66 -26.18 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 177.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -74.1 -32.4 63.2 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.038 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.66 HG21 HD12 ' B' ' 686' ' ' ILE . 20.1 mm -60.67 -48.74 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 121.153 0.501 . . . . 0.0 110.476 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 72.5 mt -67.19 -36.63 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 121.379 0.609 . . . . 0.0 109.669 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mt -58.69 -37.82 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.72 -41.38 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . 0.402 ' O ' HG13 ' A' ' 693' ' ' ILE . . . -58.03 -33.92 70.81 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -67.35 -38.29 84.59 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.886 0.85 . . . . 0.0 110.514 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.474 HD23 HD11 ' C' ' 693' ' ' ILE . 0.3 OUTLIER -59.26 -42.01 90.16 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.463 -177.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.427 ' CD1' HD13 ' B' ' 692' ' ' LEU . 1.9 pp -64.95 -41.6 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.589 -0.695 . . . . 0.0 110.386 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.41 -18.36 50.2 Favored Glycine 0 CA--C 1.541 1.703 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.03 -38.24 87.9 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.789 0.804 . . . . 0.0 109.562 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.458 ' HD2' ' N ' ' A' ' 696' ' ' ARG . 7.7 mpt_? -55.58 -28.71 56.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.585 0.754 . . . . 0.0 111.963 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.4 -41.59 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 O-C-N 121.472 -0.767 . . . . 0.0 109.094 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.737 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -67.51 -30.25 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.251 -0.906 . . . . 0.0 110.078 177.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.39 -28.65 55.4 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.588 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.1 72.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.5 m -60.97 -37.4 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 121.684 -0.635 . . . . 0.0 109.74 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.02 -44.02 97.6 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.128 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 2.1 p -62.69 -32.53 73.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.898 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.562 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.2 OUTLIER -63.28 -43.82 96.83 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.385 1.088 . . . . 0.0 108.585 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.474 HG22 HD12 ' A' ' 748' ' ' LEU . 93.4 t -66.68 -41.92 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.431 178.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.29 -39.08 91.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.063 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -61.66 -48.68 79.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.104 0.954 . . . . 0.0 111.04 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.417 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -71.71 -44.39 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 122.29 1.043 . . . . 0.0 109.655 -179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -68.24 -20.57 64.82 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.871 -178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -97.11 -21.61 17.25 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.03 -1.044 . . . . 0.0 113.744 -177.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.06 69.98 0.72 Allowed Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.704 -0.622 . . . . 0.0 114.291 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 33.1 -134.73 0.03 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.416 ' CB ' HG21 ' C' ' 708' ' ' VAL . 97.3 p -62.81 159.33 45.75 Favored Pre-proline 0 C--N 1.353 0.752 0 O-C-N 121.166 -0.959 . . . . 0.0 112.01 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.72 105.74 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.189 0 C-N-CA 121.254 1.303 . . . . 0.0 111.504 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.7 pt? -101.34 -20.3 15.26 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.4 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 2.1 t . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 122.116 0.96 . . . . 0.0 109.41 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 122.157 0.98 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -57.93 -25.33 60.76 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.536 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -6.84 0.13 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -177.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 746' ' ' ILE . 9.9 ttm180 -59.71 -45.56 91.78 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.516 ' HA ' HD13 ' C' ' 781' ' ' ILE . 2.4 p30 -59.78 -32.13 70.32 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.662 0.744 . . . . 0.0 109.633 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -71.07 -46.09 62.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 121.487 -0.758 . . . . 0.0 111.075 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 97.3 p -58.27 -31.62 67.61 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.493 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.577 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -65.93 -47.26 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 116.918 -1.515 . . . . 0.0 113.726 -179.2 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 747' ' ' ARG . 0.0 OUTLIER -86.78 -16.66 35.62 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 122.508 2.413 . . . . 0.0 108.597 178.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 748' ' ' LEU . 0.6 OUTLIER -56.03 -18.82 10.5 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 172.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.544 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 0.4 OUTLIER -55.83 -50.37 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 174.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.481 ' ND2' HG12 ' A' ' 749' ' ' VAL . 3.7 m-80 -71.19 -23.1 61.97 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 122.584 1.183 . . . . 0.0 107.965 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.19 -18.33 20.28 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.401 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.5 p -56.49 -36.26 68.93 Favored 'General case' 0 C--N 1.344 0.361 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.15 -47.85 84.29 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 176.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.18 74.08 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.427 HD22 HG12 ' A' ' 701' ' ' VAL . 8.9 tt -59.7 -45.3 92.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.453 0.644 . . . . 0.0 110.492 -178.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.9 mm -61.62 -33.18 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.31 -30.65 69.69 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.731 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.719 ' CG ' HD13 ' B' ' 715' ' ' LEU . 1.7 m-20 -55.44 -43.43 75.4 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.279 -0.888 . . . . 0.0 109.654 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -70.14 -44.76 68.21 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.315 0.578 . . . . 0.0 111.034 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.83 -35.66 81.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.279 0.561 . . . . 0.0 111.737 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.56 -35.22 65.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.943 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 13.1 t -69.64 -45.58 68.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.446 0.641 . . . . 0.0 111.094 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.726 ' HA ' HD13 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -68.76 -55.16 12.17 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -179.472 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . 0.428 ' HB3' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -98.91 -49.68 4.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.537 0.684 . . . . 0.0 112.771 -179.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 12.0 tp 74.18 -62.2 0.47 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -137.96 134.86 35.42 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 58.67 174.51 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.07 0.462 . . . . 0.0 110.056 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -98.87 -27.04 14.09 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.042 -0.411 . . . . 0.0 111.266 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -52.94 -49.59 65.73 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.586 0.708 . . . . 0.0 110.493 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -56.55 -28.01 59.08 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.279 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.436 HD13 ' CE1' ' A' ' 768' ' ' TYR . 0.9 OUTLIER -57.62 -30.77 65.62 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.794 -0.566 . . . . 0.0 110.514 -176.371 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -62.4 -31.84 72.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.521 0.676 . . . . 0.0 109.291 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.33 -47.82 84.38 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.793 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.726 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.6 tt -58.89 -42.13 88.83 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.548 -179.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.16 -40.13 84.65 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.879 -0.513 . . . . 0.0 112.306 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . 0.434 ' O ' HG22 ' A' ' 779' ' ' THR . 60.6 mt -72.03 -37.73 69.67 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.39 -36.67 73.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.71 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.24 -46.38 77.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -63.82 -35.44 80.61 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.763 0.792 . . . . 0.0 110.293 178.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 23.7 tpt85 -67.09 -43.39 82.69 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.8 mt -63.59 -41.13 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.312 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 779' ' ' THR . 3.5 m -61.44 -38.67 80.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 121.499 -0.75 . . . . 0.0 110.272 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -61.25 -49.65 76.24 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 111.092 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.14 -44.12 69.53 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.202 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.414 HD23 ' ND2' ' B' ' 750' ' ' ASN . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.61 0 CA-C-O 120.862 0.363 . . . . 0.0 111.826 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.679 ' HG ' HD22 ' B' ' 661' ' ' LEU . 4.3 tp . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.679 HD22 ' HG ' ' B' ' 660' ' ' LEU . 1.3 mm? 52.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.954 0.883 . . . . 0.0 111.056 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -171.43 -176.68 1.9 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.469 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.618 HD12 HD13 ' C' ' 660' ' ' LEU . 0.7 OUTLIER -53.52 -43.84 68.67 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.812 0.815 . . . . 0.0 110.105 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -71.69 -31.48 66.82 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.355 -0.838 . . . . 0.0 112.537 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -44.94 21.2 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.316 0.579 . . . . 0.0 110.918 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -70.62 -42.1 71.38 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.369 0.604 . . . . 0.0 110.654 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.04 -20.92 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.33 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.0 p -65.47 -35.2 80.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.221 0.534 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.42 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -59.67 -31.46 69.57 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.272 0.558 . . . . 0.0 110.931 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -59.88 -24.46 64.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.096 0.474 . . . . 0.0 111.201 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -84.57 -27.72 27.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.264 0.554 . . . . 0.0 111.189 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -60.73 -53.15 60.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.482 0.658 . . . . 0.0 110.67 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.51 41.69 7.19 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.775 0.797 . . . . 0.0 111.538 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -156.68 -63.34 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.631 -0.668 . . . . 0.0 111.371 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.634 HG13 HD23 ' B' ' 679' ' ' LEU . 7.1 tp -68.42 -37.33 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.803 -0.561 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.7 m -52.36 -33.64 43.95 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.141 -0.349 . . . . 0.0 111.501 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . 0.404 ' OD1' ' CZ ' ' B' ' 681' ' ' TYR . 43.0 m-20 -62.12 -49.21 76.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.292 0.568 . . . . 0.0 110.166 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.645 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.6 t90 -65.62 -44.24 87.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 121.749 0.785 . . . . 0.0 109.814 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.634 HD23 HG13 ' B' ' 675' ' ' ILE . 3.7 mm? -64.78 -35.29 80.62 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -94.39 -34.81 12.62 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . 0.404 ' CZ ' ' OD1' ' B' ' 677' ' ' ASN . 20.7 m-30 -71.2 -20.95 62.21 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.928 -0.483 . . . . 0.0 111.77 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.775 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.6 -36.43 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 121.9 -0.5 . . . . 0.0 110.224 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . 0.775 ' N ' HD12 ' B' ' 682' ' ' ILE . 9.3 ttt-85 -54.52 -47.47 73.07 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.015 0.436 . . . . 0.0 110.875 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.438 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -69.04 -37.16 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.463 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.0 -30.43 69.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.427 -179.091 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.66 HD12 HG21 ' A' ' 686' ' ' ILE . 13.8 mm -60.62 -48.78 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 121.877 -0.515 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 81.4 mt -61.71 -42.24 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.09 -37.74 69.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 685' ' ' PHE . 68.5 t -56.22 -39.87 62.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.06 -27.16 68.41 Favored Glycine 0 CA--C 1.543 1.815 0 O-C-N 121.759 -0.588 . . . . 0.0 112.083 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.8 m -64.69 -45.89 84.69 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.621 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.41 -33.08 70.8 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -175.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.683 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -60.06 -41.5 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.23 -0.919 . . . . 0.0 109.278 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.545 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.2 -29.7 71.9 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 177.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.576 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -60.35 -37.62 81.24 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.943 0.877 . . . . 0.0 110.056 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 23.8 mmt180 -55.35 -27.42 47.18 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.206 1.188 . . . . 0.0 114.206 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.545 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.0 tp -58.0 -36.22 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 120.623 -1.298 . . . . 0.0 109.796 -176.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.576 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.0 p -66.67 -30.98 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.586 -0.696 . . . . 0.0 109.577 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.3 m-85 -56.6 -30.59 63.41 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.52 76.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.402 ' O ' HG23 ' B' ' 705' ' ' VAL . 0.5 OUTLIER -65.85 -40.81 88.63 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.3 tp -57.39 -37.97 73.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.123 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 48.0 m -64.12 -41.44 97.23 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.884 0.849 . . . . 0.0 109.885 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -43.58 98.41 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 122.162 0.982 . . . . 0.0 109.124 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 701' ' ' VAL . 97.9 t -67.51 -40.83 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.165 -0.925 . . . . 0.0 108.878 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.69 -36.76 83.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.072 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.562 ' NH2' HD22 ' A' ' 704' ' ' LEU . 63.0 mtt-85 -61.94 -47.21 85.9 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 122.263 1.03 . . . . 0.0 109.931 -179.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.524 HG21 ' HA ' ' C' ' 713' ' ' SER . 3.7 t -76.95 -45.55 30.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.727 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -37.96 65.11 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.368 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.629 ' O ' HD12 ' B' ' 715' ' ' LEU . 0.0 OUTLIER -101.95 -22.09 14.38 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.124 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 110.08 146.5 11.16 Favored Glycine 0 CA--C 1.53 1.006 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -89.5 -60.55 1.91 Allowed 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.09 -0.653 . . . . 0.0 112.339 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.71 159.31 85.65 Favored Pre-proline 0 CA--C 1.538 0.513 0 O-C-N 121.516 -0.74 . . . . 0.0 109.33 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.43 ' HB3' HD23 ' A' ' 748' ' ' LEU . 43.3 Cg_exo -27.47 139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.931 2.421 . . . . 0.0 114.26 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.719 HD13 ' CG ' ' A' ' 758' ' ' ASP . 8.7 tt -106.22 -20.46 13.39 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 122.396 1.093 . . . . 0.0 111.814 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 122.095 0.95 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -57.99 -26.64 62.61 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.262 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -13.58 1.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.811 -0.556 . . . . 0.0 112.264 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.53 ' HE ' HD12 ' A' ' 774' ' ' LEU . 51.4 mtm-85 -66.01 -46.29 78.47 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.498 -0.751 . . . . 0.0 110.915 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -30.97 67.57 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.728 -0.607 . . . . 0.0 109.588 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -48.87 51.82 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.416 0.627 . . . . 0.0 109.716 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.3 p -58.35 -44.43 88.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 122.111 -0.368 . . . . 0.0 110.643 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.66 -20.16 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.49 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -59.43 -33.69 71.57 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.6 ' O ' HD23 ' B' ' 748' ' ' LEU . 0.9 OUTLIER -58.67 -16.28 15.57 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 22.3 t -55.96 -53.8 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.414 ' ND2' HD23 ' A' ' 785' ' ' LEU . 4.4 m-80 -72.04 -24.73 61.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.067 175.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.2 -20.6 36.32 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.236 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 2.3 m -58.99 -40.6 85.34 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 121.99 -0.712 . . . . 0.0 109.238 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.9 tp -65.7 -51.15 61.62 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.401 0.62 . . . . 0.0 109.378 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.65 -35.17 75.55 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.187 0.518 . . . . 0.0 111.345 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.43 -45.23 92.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.173 0.511 . . . . 0.0 110.891 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.02 -37.64 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -68.82 -30.34 68.87 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.301 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' C' ' 715' ' ' LEU . 68.1 m-20 -55.25 -49.32 72.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.346 -0.846 . . . . 0.0 110.27 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.42 -41.09 73.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.723 0.773 . . . . 0.0 110.567 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -36.23 83.45 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.198 -178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.1 -50.28 9.24 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.256 0.55 . . . . 0.0 111.775 -178.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 61.6 m -61.81 -46.09 91.02 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.825 0.821 . . . . 0.0 111.116 -178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.502 ' O ' HD13 ' B' ' 774' ' ' LEU . 8.4 tt -69.02 -53.67 19.26 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' B' ' 771' ' ' LEU . 1.2 m -97.73 -39.43 9.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -176.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . 0.544 HD13 HD11 ' B' ' 774' ' ' LEU . 0.5 OUTLIER 81.8 -167.59 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -177.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -38.37 -66.88 0.23 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 9.5 t -114.82 168.96 9.44 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.606 0.717 . . . . 0.0 111.713 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.92 -17.64 62.08 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.114 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -38.94 91.94 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -67.86 -29.91 69.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.744 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' B' ' 764' ' ' SER . 6.6 tt -59.79 -34.62 73.27 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 122.023 -0.423 . . . . 0.0 109.961 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 40.6 mmm-85 -61.19 -37.95 84.81 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.94 -43.64 74.66 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.283 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.544 HD11 HD13 ' B' ' 765' ' ' LEU . 9.3 mt -66.99 -38.21 85.61 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.752 0.787 . . . . 0.0 110.584 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.695 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -66.91 -38.62 86.57 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.022 -179.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.42 -41.65 60.53 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.554 -0.716 . . . . 0.0 111.567 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . 0.575 HD12 ' N ' ' B' ' 778' ' ' VAL . 2.7 pp -68.19 -37.09 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 120.524 -0.471 . . . . 0.0 110.501 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.575 ' N ' HD12 ' B' ' 777' ' ' ILE . 0.7 OUTLIER -55.56 -45.5 78.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.655 -0.653 . . . . 0.0 109.328 -179.296 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.818 ' O ' HG22 ' B' ' 782' ' ' VAL . 29.7 p -64.46 -42.13 96.11 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 111.395 178.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -31.82 72.37 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.433 ' HB ' HG21 ' C' ' 746' ' ' ILE . 79.3 mt -61.07 -36.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.818 HG22 ' O ' ' B' ' 779' ' ' THR . 11.4 m -54.16 -37.4 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.413 -0.805 . . . . 0.0 110.043 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -54.31 -46.32 72.77 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.528 0.68 . . . . 0.0 110.505 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.23 -44.32 84.12 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.051 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' C' ' 747' ' ' ARG . 5.1 tp -71.77 -23.91 61.66 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.183 0.516 . . . . 0.0 111.129 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.86 -41.45 20.58 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.49 128.94 33.99 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.603 0.716 . . . . 0.0 110.462 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.071 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.618 HD13 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 121.592 0.71 . . . . 0.0 109.218 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 49.3 mt 59.96 113.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.46 0.648 . . . . 0.0 110.9 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -172.88 170.44 4.55 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.881 0.848 . . . . 0.0 110.524 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.67 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -55.49 -53.97 49.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.466 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.67 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.4 t70 -72.7 -15.74 61.68 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.775 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.06 -42.57 31.85 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.141 0.496 . . . . 0.0 110.896 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -69.2 -46.14 68.17 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.461 0.648 . . . . 0.0 110.949 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.66 -27.84 66.73 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.652 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 32.8 t -63.23 -26.49 68.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.138 0.494 . . . . 0.0 111.694 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -39.75 95.09 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.093 0.473 . . . . 0.0 111.569 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -60.44 -21.17 62.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.017 0.437 . . . . 0.0 111.642 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -79.13 -29.4 43.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.358 0.599 . . . . 0.0 111.093 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -58.45 -52.18 66.71 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.592 0.71 . . . . 0.0 110.51 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.6 t80 58.54 59.9 2.77 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.173 0.987 . . . . 0.0 111.068 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -176.0 -76.26 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.138 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.424 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.4 OUTLIER -67.42 -36.76 77.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-O 121.593 0.711 . . . . 0.0 111.947 -178.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 8.0 m -51.41 -32.43 26.33 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -55.79 -43.51 76.89 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.708 -0.62 . . . . 0.0 110.986 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.623 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.68 -44.52 96.79 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.512 0.673 . . . . 0.0 109.863 179.246 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.86 81.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.015 0.436 . . . . 0.0 111.792 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -88.33 -17.87 29.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -101.45 -20.34 15.17 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.687 -0.633 . . . . 0.0 112.121 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.762 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -60.5 -36.68 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 O-C-N 121.784 -0.573 . . . . 0.0 110.904 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.762 ' N ' HD12 ' C' ' 682' ' ' ILE . 5.6 ttt-85 -58.22 -46.74 85.34 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.717 0.77 . . . . 0.0 109.378 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 59.1 mt -71.15 -35.18 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-O 121.391 0.615 . . . . 0.0 109.673 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.52 -31.11 69.09 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.9 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.412 HD12 ' CG2' ' B' ' 686' ' ' ILE . 14.0 mm -61.05 -44.2 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 75.5 mt -62.25 -37.5 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 177.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.17 -40.95 85.01 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 86.7 t -54.97 -43.83 70.88 Favored 'Isoleucine or valine' 0 C--N 1.347 0.471 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.44 -39.2 43.87 Favored Glycine 0 CA--C 1.534 1.23 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.39 -38.88 85.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.307 1.051 . . . . 0.0 109.519 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -61.01 -46.26 91.47 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.474 HD11 HD23 ' A' ' 692' ' ' LEU . 1.3 pp -65.75 -41.57 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.388 0.613 . . . . 0.0 110.157 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.575 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.8 -35.23 89.65 Favored Glycine 0 CA--C 1.535 1.319 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.585 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.0 tt -56.11 -37.62 69.66 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.086 0.946 . . . . 0.0 110.095 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.683 ' HE ' HD11 ' B' ' 693' ' ' ILE . 31.1 mmt180 -55.83 -28.17 55.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.575 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.5 tt -58.28 -35.59 54.21 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 121.158 -0.964 . . . . 0.0 111.082 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.585 HG12 ' O ' ' C' ' 695' ' ' LEU . 10.8 p -54.28 -29.68 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -56.22 -31.14 63.24 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.728 -0.607 . . . . 0.0 110.735 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.07 -37.66 77.62 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.23 -40.91 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.54 -38.34 84.13 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.536 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 43.8 p -64.17 -36.49 84.22 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.286 0.565 . . . . 0.0 110.594 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -43.29 96.8 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 122.174 0.988 . . . . 0.0 108.533 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.94 -45.05 99.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.883 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -62.71 -36.77 84.05 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.407 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.453 ' HG2' ' HB3' ' C' ' 712' ' ' TYR . 0.0 OUTLIER -62.13 -50.22 72.76 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.409 -0.807 . . . . 0.0 110.333 -177.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.418 HG12 ' CD1' ' C' ' 748' ' ' LEU . 0.9 OUTLIER -77.57 -44.19 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -177.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.06 -44.58 65.49 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -104.1 -22.25 13.45 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.34 173.82 16.09 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . 0.453 ' HB3' ' HG2' ' C' ' 707' ' ' ARG . 14.3 p90 -134.49 -58.37 0.83 Allowed 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.6 -0.941 . . . . 0.0 112.628 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.524 ' HA ' HG21 ' B' ' 708' ' ' VAL . 53.1 p -64.19 154.46 82.64 Favored Pre-proline 0 C--N 1.343 0.307 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.574 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -36.41 96.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.806 0 C-N-CA 121.933 1.755 . . . . 0.0 111.554 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.477 HD23 ' OD2' ' B' ' 758' ' ' ASP . 5.8 tp -82.83 16.85 2.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -175.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.009 0.909 . . . . 0.0 109.728 179.134 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 121.824 0.821 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -40.79 95.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.094 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.72 -38.1 77.62 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.063 0.459 . . . . 0.0 111.821 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.501 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.3 ttm-85 -58.3 -36.51 73.44 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.099 -0.376 . . . . 0.0 111.191 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.52 -42.98 88.95 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -71.28 -44.17 65.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.71 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -27.97 58.98 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.36 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -58.15 -14.64 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . 0.477 ' HA ' HD22 ' B' ' 785' ' ' LEU . 0.1 OUTLIER -59.45 -25.5 64.42 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 121.315 -0.865 . . . . 0.0 108.783 178.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' C' ' 708' ' ' VAL . 0.8 OUTLIER -55.38 -24.71 31.36 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.885 177.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.76 -54.03 30.78 Favored 'Isoleucine or valine' 0 C--N 1.349 0.577 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.456 ' ND2' HD23 ' B' ' 785' ' ' LEU . 5.4 m-80 -72.54 -22.81 60.96 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.746 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.73 36.05 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.136 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.8 t -58.78 -40.87 85.25 Favored 'General case' 0 C--O 1.234 0.237 0 O-C-N 122.031 -0.688 . . . . 0.0 109.458 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.63 -48.96 67.81 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.371 0.605 . . . . 0.0 110.254 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . 0.4 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.89 -35.22 79.94 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 111.86 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.459 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.4 tt -59.26 -45.16 91.95 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 110.74 -178.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 51.1 mt -68.55 -36.36 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 121.502 0.668 . . . . 0.0 109.714 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.66 -30.36 69.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.34 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -55.44 -45.37 76.84 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.737 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -45.18 66.16 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 179.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.86 -45.96 69.69 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -67.3 -47.82 69.45 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.3 m -64.07 -45.15 90.02 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.901 0.858 . . . . 0.0 110.58 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.39 -53.31 24.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.0 OUTLIER -98.23 -36.92 9.88 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.044 -1.035 . . . . 0.0 113.309 -177.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' C' ' 766' ' ' PHE . 60.5 mt 65.0 177.68 0.19 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -177.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . 0.416 ' C ' ' O ' ' C' ' 765' ' ' LEU . 27.6 t80 -7.01 -66.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -178.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 54.7 p -130.38 172.38 11.93 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.171 0.51 . . . . 0.0 110.676 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.82 -15.73 63.77 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.792 0.33 . . . . 0.0 111.32 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -63.76 -42.16 97.86 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -64.07 -30.33 71.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.801 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' C' ' 764' ' ' SER . 0.8 OUTLIER -60.16 -32.3 70.92 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.953 -0.467 . . . . 0.0 110.015 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 17.3 ttt-85 -62.6 -38.82 91.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -67.7 -43.95 78.88 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.446 HD22 HD12 ' C' ' 777' ' ' ILE . 3.3 mm? -61.39 -37.47 83.54 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.435 ' O ' HG22 ' C' ' 778' ' ' VAL . 1.0 OUTLIER -57.71 -36.26 71.76 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.243 1.021 . . . . 0.0 108.707 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 776' ' ' LEU . 8.6 tt -74.31 -41.33 61.33 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.704 0.764 . . . . 0.0 109.543 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.728 HG22 HD11 ' C' ' 781' ' ' ILE . 94.3 mt -60.91 -45.63 97.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.87 -179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.493 HG12 HG12 ' A' ' 746' ' ' ILE . 32.7 m -57.74 -39.19 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.57 -0.706 . . . . 0.0 111.102 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.589 ' O ' HG22 ' C' ' 782' ' ' VAL . 7.2 m -63.22 -48.02 80.05 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.629 -0.67 . . . . 0.0 112.065 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -31.81 72.0 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.751 -0.593 . . . . 0.0 111.451 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.728 HD11 HG22 ' C' ' 777' ' ' ILE . 63.4 mt -60.1 -40.22 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.368 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.589 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -53.02 -38.03 28.14 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 CA-C-N 120.185 1.357 . . . . 0.0 109.555 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.553 1.076 0 O-C-N 121.786 -0.571 . . . . 0.0 109.588 178.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.514 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.5 mp 61.57 116.34 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.469 0.652 . . . . 0.0 110.279 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -177.33 173.39 1.74 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.491 0.662 . . . . 0.0 110.086 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -51.68 -43.25 62.66 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.675 0.75 . . . . 0.0 111.118 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.31 -34.89 71.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.752 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.0 mmtt -72.03 -43.08 65.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.178 0.514 . . . . 0.0 111.301 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -67.07 -46.41 74.36 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.133 0.492 . . . . 0.0 110.596 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.44 90.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.376 0.608 . . . . 0.0 111.446 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.26 -33.25 69.18 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.248 0.547 . . . . 0.0 111.085 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.917 HD23 HG23 ' A' ' 676' ' ' THR . 10.9 tp -62.5 -25.57 68.08 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.168 -0.332 . . . . 0.0 111.799 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -61.3 -24.68 66.59 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.736 -0.603 . . . . 0.0 111.127 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -74.87 -31.38 61.6 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.334 0.588 . . . . 0.0 110.858 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 17.7 m95 -55.43 -50.46 69.74 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.683 0.754 . . . . 0.0 109.942 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 17.5 t80 58.7 12.34 2.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -124.98 -60.36 1.36 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.595 -0.691 . . . . 0.0 110.55 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -68.49 -36.66 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.485 0.66 . . . . 0.0 110.751 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.917 HG23 HD23 ' A' ' 669' ' ' LEU . 0.2 OUTLIER -51.72 -33.87 36.49 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -175.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -63.7 -49.75 71.88 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.2 0.909 . . . . 0.0 110.253 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.749 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.6 t90 -65.59 -43.85 88.43 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.724 0.773 . . . . 0.0 109.525 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -35.71 81.87 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.8 t90 -101.64 -17.84 16.14 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -92.41 -8.21 45.45 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.432 -0.792 . . . . 0.0 112.053 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.749 HG23 ' O ' ' A' ' 678' ' ' TRP . 5.3 pt -61.06 -36.96 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.708 -0.62 . . . . 0.0 111.002 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.88 -47.44 71.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.946 0.403 . . . . 0.0 110.578 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.0 mp -70.71 -33.45 52.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 177.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.503 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.5 OUTLIER -59.81 -32.48 70.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.892 -179.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.968 HD12 HG21 ' C' ' 686' ' ' ILE . 11.0 mm -62.68 -43.25 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-O 121.526 0.679 . . . . 0.0 109.19 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 54.5 mt -66.65 -41.23 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.99 -38.27 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 685' ' ' PHE . 78.7 t -56.99 -41.03 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 177.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -58.31 -39.26 92.38 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 177.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -61.22 -38.9 88.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.318 1.056 . . . . 0.0 109.663 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.56 -46.1 91.46 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.791 -178.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.635 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -58.04 -42.2 82.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.72 -36.54 92.87 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.466 ' O ' HD23 ' A' ' 695' ' ' LEU . 2.8 tt -59.57 -41.88 91.2 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.835 0.826 . . . . 0.0 110.146 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.476 ' HG3' HD13 ' C' ' 693' ' ' ILE . 30.8 mmt180 -56.12 -28.55 58.3 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 49.1 mm -58.96 -35.68 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.52 -0.738 . . . . 0.0 110.831 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 4.1 p -53.98 -29.56 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 O-C-N 121.436 -0.79 . . . . 0.0 110.126 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -55.65 -30.85 61.71 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.843 -0.536 . . . . 0.0 110.41 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.72 77.44 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.21 -41.17 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.25 -36.98 76.45 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.746 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . 0.429 ' HA ' ' HB2' ' A' ' 706' ' ' ASN . 0.9 OUTLIER -61.98 -41.66 98.28 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.358 0.599 . . . . 0.0 110.507 -178.308 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 704' ' ' LEU . 0.8 OUTLIER -60.94 -40.91 95.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 122.026 0.917 . . . . 0.0 108.982 178.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -68.33 -41.82 83.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.914 0.864 . . . . 0.0 108.908 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 703' ' ' SER . 2.3 m120 -62.72 -45.01 94.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -61.08 -39.33 89.5 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.815 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.9 -44.48 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 122.246 1.022 . . . . 0.0 108.824 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -69.56 -16.81 63.49 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.595 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -93.84 7.75 43.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.494 -0.754 . . . . 0.0 112.644 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 71.83 42.7 52.57 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 110.121 -1.191 . . . . 0.0 110.121 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.55 -167.47 0.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.117 0.961 . . . . 0.0 109.935 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.548 ' OG ' HG23 ' C' ' 708' ' ' VAL . 16.8 p -62.72 160.35 36.66 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.671 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.416 ' CG ' HD12 ' C' ' 748' ' ' LEU . 10.7 Cg_exo -24.34 100.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 123.86 3.04 . . . . 0.0 115.608 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.667 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.3 pt? -109.55 -20.26 12.93 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.336 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 123.068 1.414 . . . . 0.0 109.863 -178.527 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 124.244 1.973 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.38 -25.24 59.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 113.64 -1.618 . . . . 0.0 112.486 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -54.21 -30.27 49.33 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.567 ' O ' HD12 ' A' ' 746' ' ' ILE . 2.4 ttp180 -61.12 -42.68 98.98 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.406 -0.809 . . . . 0.0 110.775 178.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.93 -44.34 91.33 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.799 0.809 . . . . 0.0 110.02 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -36.89 72.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . 0.449 ' HA ' HD23 ' A' ' 748' ' ' LEU . 42.9 p -64.58 -28.17 69.45 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.786 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.567 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.9 OUTLIER -74.0 -47.1 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.695 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.532 ' O ' ' HG3' ' A' ' 747' ' ' ARG 0.28 9.4 ttt180 -71.9 0.73 8.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.763 -178.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.538 HD21 ' CG ' ' B' ' 714' ' ' PRO . 1.1 mm? -55.71 -16.61 4.48 Favored 'General case' 0 C--N 1.375 1.691 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 168.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.313 1.4 t -53.52 -54.77 16.64 Favored 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.504 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.4 m-80 -73.52 -28.38 61.86 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.261 174.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.15 -20.49 35.57 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.528 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 81.2 p -58.23 -37.58 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.741 0.77 . . . . 0.0 109.187 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 38.1 tp -66.75 -51.14 59.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.185 0.517 . . . . 0.0 109.748 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.62 -35.07 79.3 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.226 0.536 . . . . 0.0 112.106 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.492 HD21 ' NE2' ' B' ' 710' ' ' GLN . 4.7 tt -59.18 -45.36 91.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.977 0.417 . . . . 0.0 111.411 -177.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.4 mt -65.41 -31.88 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 121.335 0.588 . . . . 0.0 109.862 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.54 -30.74 68.63 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 122.049 -0.407 . . . . 0.0 111.799 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -55.67 -46.59 77.53 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.586 -0.696 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -43.32 70.09 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.461 0.648 . . . . 0.0 110.899 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 763' ' ' LEU . 7.2 mt -60.99 -33.36 73.11 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.253 0.549 . . . . 0.0 111.463 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 765' ' ' LEU . 71.6 mtt180 -82.33 -22.15 35.72 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.4 m -75.3 -46.68 31.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 120.959 -1.088 . . . . 0.0 112.299 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.452 HD11 ' HA ' ' A' ' 760' ' ' LEU . 0.1 OUTLIER -69.65 -53.72 17.34 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -41.49 8.2 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.411 ' HA ' ' O ' ' A' ' 761' ' ' ARG . 1.2 tt 92.1 -64.58 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.212 1.005 . . . . 0.0 111.787 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -151.2 25.08 0.72 Allowed 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.616 -0.677 . . . . 0.0 112.732 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 18.9 p -176.34 138.33 0.31 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.596 -0.69 . . . . 0.0 110.818 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.86 -5.34 25.12 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.861 0.362 . . . . 0.0 111.46 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -82.83 -38.6 22.82 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -61.31 -30.28 70.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.258 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.98 -33.42 71.92 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.043 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -57.03 -38.06 72.62 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.28 -38.13 78.2 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.639 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.538 ' C ' HD13 ' A' ' 774' ' ' LEU . 2.8 tm? -58.19 -39.57 79.28 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 121.302 0.572 . . . . 0.0 109.805 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.65 -36.2 80.12 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.547 0.689 . . . . 0.0 110.783 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -45.36 52.5 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.962 0.41 . . . . 0.0 111.161 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.796 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -69.94 -37.59 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 122.046 -0.409 . . . . 0.0 110.076 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.796 ' N ' HD13 ' A' ' 777' ' ' ILE . 13.4 p -61.64 -42.87 95.87 Favored 'Isoleucine or valine' 0 C--N 1.348 0.54 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.848 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.1 m -64.21 -35.84 82.13 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.306 0.574 . . . . 0.0 110.33 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . 0.692 ' NH2' HD21 ' A' ' 784' ' ' LEU . 0.7 OUTLIER -63.67 -37.65 88.14 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.611 HG21 HG23 ' B' ' 746' ' ' ILE . 72.8 mt -54.01 -39.71 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 121.796 -0.565 . . . . 0.0 111.342 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.848 HG22 ' O ' ' A' ' 779' ' ' THR . 6.8 m -54.76 -35.75 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 120.933 0.397 . . . . 0.0 111.041 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -53.81 -51.12 64.51 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -176.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.692 HD21 ' NH2' ' A' ' 780' ' ' ARG . 0.0 OUTLIER -70.59 -32.98 70.55 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.47 0.538 0 O-C-N 121.751 -0.593 . . . . 0.0 111.94 -178.021 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.51 HD12 ' N ' ' B' ' 660' ' ' LEU . 6.5 mp . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.707 0.765 . . . . 0.0 109.115 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.468 HD12 ' N ' ' B' ' 661' ' ' LEU . 7.9 mp 45.5 90.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.556 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.76 52.42 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 122.112 0.958 . . . . 0.0 111.409 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.623 ' CD1' HD22 ' C' ' 660' ' ' LEU . 13.6 tp 77.77 -46.45 0.46 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.275 1.03 . . . . 0.0 110.151 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -34.29 72.12 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.438 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.64 -41.38 27.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.825 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -75.19 -42.4 55.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.04 0.448 . . . . 0.0 111.742 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.96 -29.69 64.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.393 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.5 m -62.43 -33.79 75.49 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.084 0.468 . . . . 0.0 111.195 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -27.19 68.93 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.027 0.441 . . . . 0.0 111.588 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.0 m95 -59.79 -32.62 70.79 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.156 0.503 . . . . 0.0 111.002 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -69.6 -27.86 65.46 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.105 0.479 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -67.86 -61.5 1.84 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.513 0.673 . . . . 0.0 110.336 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 11.9 t80 63.53 24.49 14.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -132.64 -82.15 0.49 Allowed 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.446 -0.784 . . . . 0.0 111.23 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.711 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.2 OUTLIER -62.42 -36.04 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.417 0.627 . . . . 0.0 110.611 179.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.0 m -50.73 -33.13 21.75 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.02 -0.425 . . . . 0.0 110.749 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 19.7 m-20 -56.48 -49.71 73.86 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' B' ' 682' ' ' ILE . 4.1 t90 -66.06 -43.57 87.04 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.81 0.814 . . . . 0.0 109.357 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 675' ' ' ILE . 0.1 OUTLIER -58.15 -35.15 71.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.064 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -105.55 -33.74 8.0 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -176.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -70.09 -8.71 51.66 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.33 -35.8 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.506 -0.746 . . . . 0.0 111.456 179.542 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -47.3 68.74 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 122.118 -0.364 . . . . 0.0 110.907 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.463 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -68.31 -36.21 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.493 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.6 OUTLIER -59.82 -30.8 69.18 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.246 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.896 HD12 HG21 ' A' ' 686' ' ' ILE . 13.0 mm -60.91 -47.11 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.142 0.496 . . . . 0.0 109.762 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 70.3 mt -61.21 -39.44 82.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' B' ' 685' ' ' PHE . 96.6 mt -58.72 -37.57 66.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 685' ' ' PHE . 96.9 t -56.17 -41.93 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.52 -28.21 59.35 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.2 -37.44 87.49 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.996 0.518 . . . . 0.0 110.975 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.26 -45.83 87.12 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.224 0.535 . . . . 0.0 109.997 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.74 HD11 ' NE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -68.34 -40.25 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 O-C-N 122.174 -0.329 . . . . 0.0 110.945 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.694 ' O ' HD12 ' B' ' 697' ' ' ILE . . . -61.89 -38.44 96.0 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 109.906 -1.278 . . . . 0.0 109.906 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.595 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -64.62 -36.49 84.41 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.411 1.1 . . . . 0.0 110.705 178.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.628 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -54.78 -28.57 49.85 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -176.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.729 HD13 ' H ' ' B' ' 698' ' ' VAL . 0.1 OUTLIER -58.55 -35.57 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 120.839 -1.163 . . . . 0.0 110.092 -177.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.729 ' H ' HD13 ' B' ' 697' ' ' ILE . 9.9 p -54.34 -30.3 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.263 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -56.7 -31.47 64.51 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 121.96 -0.462 . . . . 0.0 109.859 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.33 -38.38 80.19 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.02 -39.2 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tp -62.0 -36.38 81.34 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.326 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -62.1 -37.18 84.1 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 122.04 -0.413 . . . . 0.0 110.563 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.46 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -63.6 -42.59 98.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 122.215 1.007 . . . . 0.0 108.349 177.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.581 HG13 HD13 ' B' ' 748' ' ' LEU . 90.4 t -64.04 -45.39 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.981 0.896 . . . . 0.0 109.05 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.81 -35.84 81.21 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.247 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.46 ' NH2' HD22 ' B' ' 704' ' ' LEU . 1.7 ttm105 -59.2 -50.47 73.89 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.822 -1.174 . . . . 0.0 110.393 -178.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.549 HG21 ' HD2' ' C' ' 714' ' ' PRO . 0.6 OUTLIER -78.59 -45.8 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.87 0.843 . . . . 0.0 112.66 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -74.1 -37.55 64.12 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.047 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.492 ' NE2' HD21 ' A' ' 755' ' ' LEU . 7.5 tt0 -102.07 7.37 41.16 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . 0.422 ' HA3' HD13 ' B' ' 715' ' ' LEU . . . 76.65 136.01 0.68 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -77.01 -49.63 14.96 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 122.233 -0.569 . . . . 0.0 110.005 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.02 157.43 33.72 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.538 ' CG ' HD21 ' A' ' 748' ' ' LEU . 31.2 Cg_exo -36.31 108.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.102 1.868 . . . . 0.0 114.039 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.422 HD13 ' HA3' ' B' ' 711' ' ' GLY . 3.1 tp -80.11 13.93 2.09 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 27.8 p . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 -179.503 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 121.366 0.603 . . . . 0.0 111.514 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 -71.21 -26.84 63.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.897 -0.502 . . . . 0.0 111.05 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.46 -18.72 7.61 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.89 -0.506 . . . . 0.0 112.038 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -60.52 -39.68 88.66 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.917 -0.489 . . . . 0.0 111.094 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' B' ' 746' ' ' ILE . 1.0 OUTLIER -59.48 -34.75 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . 0.4 ' C ' ' HD2' ' B' ' 744' ' ' ARG . 0.7 OUTLIER -71.88 -39.4 69.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.191 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.6 m -56.23 -22.79 31.72 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.577 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.611 HG23 HG21 ' A' ' 781' ' ' ILE . 0.6 OUTLIER -52.75 -30.53 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.163 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.519 ' HA ' HD21 ' B' ' 750' ' ' ASN . 7.5 mtt180 -63.46 -14.13 47.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.418 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.581 HD13 HG13 ' B' ' 705' ' ' VAL . 55.2 mt -56.13 -40.44 73.78 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 178.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . 0.446 HG23 ' O ' ' B' ' 746' ' ' ILE . 0.1 OUTLIER -55.13 -54.12 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -176.549 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.519 HD21 ' HA ' ' B' ' 747' ' ' ARG . 3.6 p30 -72.53 -16.11 61.77 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.439 0.638 . . . . 0.0 110.582 175.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -58.13 -21.41 46.34 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 4.4 m -64.48 -44.29 91.49 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.958 -0.731 . . . . 0.0 110.341 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' B' ' 757' ' ' TRP . 17.2 tp -68.23 -45.98 71.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.056 0.932 . . . . 0.0 109.436 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.75 76.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.5 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.482 ' C ' HD23 ' B' ' 755' ' ' LEU . 6.8 tt -58.83 -46.3 88.0 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 121.839 -0.538 . . . . 0.0 110.956 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 44.9 pt -76.2 -30.19 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 121.789 0.804 . . . . 0.0 110.575 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . 0.447 ' CZ3' HD11 ' B' ' 753' ' ' LEU . 0.2 OUTLIER -69.25 -30.14 68.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.607 -179.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.15 -49.46 77.16 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.593 -0.692 . . . . 0.0 109.148 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.37 -45.33 63.11 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.687 0.756 . . . . 0.0 111.205 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . 0.492 ' C ' HD13 ' B' ' 760' ' ' LEU . 3.1 tm? -64.25 -41.67 96.85 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.345 0.593 . . . . 0.0 112.279 -177.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -82.1 -21.26 36.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 48.2 t -74.0 -45.65 48.59 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.448 -0.782 . . . . 0.0 112.151 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.663 ' HA ' HD13 ' B' ' 774' ' ' LEU . 5.9 mp -59.88 -54.94 40.32 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.09 -49.62 4.44 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.722 0.773 . . . . 0.0 112.53 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 72.15 120.85 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.656 0.741 . . . . 0.0 109.986 -178.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 15.1 t80 75.21 -69.19 0.18 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.322 0.649 . . . . 0.0 110.809 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 4.8 m -150.93 176.32 11.21 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.858 -0.526 . . . . 0.0 110.796 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.59 -172.31 0.16 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 78.35 -51.97 0.49 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.683 0.754 . . . . 0.0 108.985 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 15.1 tpt85 -56.62 -29.57 62.33 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.187 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -59.59 -31.99 69.97 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.937 -0.477 . . . . 0.0 109.874 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -57.18 -34.97 69.03 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.54 0.686 . . . . 0.0 109.181 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.01 -46.05 79.34 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.663 HD13 ' HA ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.65 -42.69 88.96 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.524 0.678 . . . . 0.0 109.325 179.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.656 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.8 tm? -59.03 -39.0 80.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.317 0.58 . . . . 0.0 110.15 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.63 -42.6 77.82 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 122.129 -0.357 . . . . 0.0 111.276 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 52.2 mt -62.89 -41.48 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.584 HG23 ' O ' ' B' ' 774' ' ' LEU . 64.8 t -61.93 -40.36 86.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.152 0.501 . . . . 0.0 110.097 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.544 ' O ' HG22 ' B' ' 782' ' ' VAL . 9.8 m -62.93 -45.84 90.6 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.013 -0.429 . . . . 0.0 112.02 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.96 72.44 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.542 -0.724 . . . . 0.0 111.846 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.492 HD12 HD13 ' C' ' 746' ' ' ILE . 83.5 mt -68.54 -40.18 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.754 -0.591 . . . . 0.0 111.891 -178.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 779' ' ' THR . 19.5 m -56.39 -38.11 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.362 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -63.25 -42.35 99.18 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.745 0.783 . . . . 0.0 109.742 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 22.8 tp -66.91 -41.57 86.9 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.8 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.409 ' HG ' ' CG ' ' C' ' 750' ' ' ASN . 0.0 OUTLIER -65.29 -35.19 80.25 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.102 0.477 . . . . 0.0 110.631 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -30.49 -51.93 0.21 Allowed Glycine 0 CA--C 1.539 1.535 0 C-N-CA 123.366 0.508 . . . . 0.0 113.04 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.59 85.87 2.44 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 122.214 1.007 . . . . 0.0 109.95 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.901 -1.047 . . . . 0.0 111.004 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.623 HD22 ' CD1' ' B' ' 663' ' ' LEU . 3.9 pp . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 121.902 0.858 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.436 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.9 mp -114.59 151.53 33.29 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.322 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -175.46 174.8 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.278 0.561 . . . . 0.0 110.29 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.455 HD23 ' C ' ' C' ' 663' ' ' LEU . 4.5 tt -49.12 -57.1 7.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.681 0.753 . . . . 0.0 111.942 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.81 -20.7 66.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.265 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -79.18 -46.11 18.57 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.068 0.461 . . . . 0.0 110.962 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -58.5 -45.91 87.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.665 0.745 . . . . 0.0 110.288 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.83 -25.61 64.75 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.298 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 p -64.73 -35.64 81.71 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.276 0.56 . . . . 0.0 110.711 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 29.9 mt -59.91 -30.75 69.25 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.184 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.6 -25.5 64.67 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.963 -0.46 . . . . 0.0 110.857 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -77.79 -27.5 50.21 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.116 0.484 . . . . 0.0 111.277 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.34 -40.63 86.96 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.358 0.599 . . . . 0.0 110.515 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 55.63 32.43 19.23 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.299 0.571 . . . . 0.0 110.985 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -151.53 -69.12 0.17 Allowed 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.646 -0.659 . . . . 0.0 111.953 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.647 HD12 ' CE3' ' C' ' 678' ' ' TRP . 1.6 tp -64.91 -37.6 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 121.83 -0.544 . . . . 0.0 112.053 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.4 m -52.51 -43.12 64.89 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.864 -0.523 . . . . 0.0 111.6 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -57.66 -46.45 84.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.659 0.742 . . . . 0.0 110.13 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.647 ' CE3' HD12 ' C' ' 675' ' ' ILE . 4.3 t90 -65.17 -45.1 86.29 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.167 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 47.4 mt -65.75 -38.96 90.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.388 -0.82 . . . . 0.0 112.698 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -84.3 -42.04 16.22 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.891 -0.505 . . . . 0.0 112.171 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -65.81 -30.02 70.59 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.981 -0.449 . . . . 0.0 112.053 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.725 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.6 pp -62.26 -36.86 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 119.89 -0.724 . . . . 0.0 109.304 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.725 ' N ' HD12 ' C' ' 682' ' ' ILE . 17.6 ttt-85 -59.67 -45.2 92.79 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.1 mm -61.35 -42.81 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.339 1.066 . . . . 0.0 108.65 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.494 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.71 -27.4 66.41 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.031 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.968 HG21 HD12 ' A' ' 686' ' ' ILE . 18.6 mm -60.27 -44.27 95.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.4 -37.74 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 38.4 mm -60.24 -39.29 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.494 HG23 ' O ' ' C' ' 685' ' ' PHE . 84.5 t -55.69 -41.26 64.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . 0.401 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.08 -40.48 74.23 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.73 -38.23 83.25 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.824 0.821 . . . . 0.0 110.36 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.482 HD23 HD12 ' B' ' 693' ' ' ILE . 3.1 tp -59.42 -46.56 88.36 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' A' ' 696' ' ' ARG . 2.5 pp -61.3 -41.55 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 121.747 -0.596 . . . . 0.0 109.913 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.713 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -61.02 -34.58 88.46 Favored Glycine 0 CA--C 1.533 1.207 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 4.8 tt -60.75 -38.05 83.86 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.267 1.032 . . . . 0.0 110.214 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.74 ' NE ' HD11 ' B' ' 693' ' ' ILE . 22.6 mmt180 -56.37 -28.33 58.85 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.713 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -58.79 -35.34 55.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 O-C-N 121.329 -0.857 . . . . 0.0 111.248 -176.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.9 p -53.72 -30.82 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.259 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -56.73 -31.58 64.68 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.832 -0.542 . . . . 0.0 110.27 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.94 88.63 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -68.92 -40.42 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.99 -37.56 71.82 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 40.0 m -62.39 -35.61 79.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.532 0.682 . . . . 0.0 109.436 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -41.85 99.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 122.343 1.068 . . . . 0.0 108.19 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.55 -45.36 97.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.458 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -62.79 -36.77 84.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.114 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.404 ' HA ' ' O ' ' C' ' 711' ' ' GLY . 3.0 ttm-85 -62.41 -50.45 71.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.507 -0.746 . . . . 0.0 111.645 -176.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.548 HG23 ' OG ' ' A' ' 713' ' ' SER . 0.4 OUTLIER -77.65 -44.34 29.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.497 0.665 . . . . 0.0 111.714 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -74.31 -43.22 57.65 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.46 -22.06 14.13 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -174.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . 0.404 ' O ' ' HA ' ' C' ' 707' ' ' ARG . . . 135.68 -157.92 23.52 Favored Glycine 0 N--CA 1.478 1.441 0 O-C-N 121.317 -0.864 . . . . 0.0 111.675 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -147.47 -50.84 0.19 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.382 -1.069 . . . . 0.0 112.556 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 73.5 m -107.75 159.68 29.49 Favored Pre-proline 0 N--CA 1.463 0.183 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.33 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . 0.549 ' HD2' HG21 ' B' ' 708' ' ' VAL . 24.7 Cg_exo -32.97 97.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.226 1.951 . . . . 0.0 112.636 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' C' ' 716' ' ' SER . 6.1 tp -70.71 -20.0 62.7 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . 0.496 ' C ' ' O ' ' C' ' 715' ' ' LEU . 2.3 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 122.09 0.947 . . . . 0.0 112.52 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 122.337 1.065 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -61.43 -26.4 67.84 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.934 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -21.3 13.6 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.89 -0.506 . . . . 0.0 111.808 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.414 ' HD2' HD12 ' B' ' 774' ' ' LEU . 31.3 mtm180 -74.28 -30.15 61.98 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.948 -0.47 . . . . 0.0 110.952 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -58.93 -44.27 91.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.564 0.697 . . . . 0.0 109.532 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -71.27 -40.37 70.99 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.213 0.53 . . . . 0.0 110.268 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 2.0 m -58.57 -41.97 86.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.843 0.354 . . . . 0.0 110.364 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.492 HD13 HD12 ' B' ' 781' ' ' ILE . 82.9 mt -58.66 -18.6 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 O-C-N 122.073 -0.392 . . . . 0.0 110.031 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -59.61 -33.3 71.3 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.416 HD12 ' CG ' ' A' ' 714' ' ' PRO . 5.2 tt -58.95 -18.78 36.86 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.579 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . 0.449 HG23 ' O ' ' C' ' 746' ' ' ILE . 93.9 t -55.69 -55.0 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.409 ' CG ' ' HG ' ' B' ' 785' ' ' LEU . 5.4 m-80 -73.58 -20.19 60.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.017 174.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.66 -20.0 30.02 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.193 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 12.6 t -58.21 -37.85 75.62 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.69 -48.78 58.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.66 74.16 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.493 ' C ' HD23 ' C' ' 755' ' ' LEU . 6.9 tt -59.75 -45.55 91.88 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.346 0.593 . . . . 0.0 110.176 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 42.5 mm -66.31 -36.37 77.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.44 0.638 . . . . 0.0 109.632 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.02 -34.12 74.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.03 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . 0.441 ' OD1' HD21 ' A' ' 715' ' ' LEU . 54.6 m-20 -56.49 -46.37 80.5 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.979 0.895 . . . . 0.0 109.16 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . 0.823 ' O ' HD22 ' C' ' 763' ' ' LEU . 2.9 m-20 -70.4 -45.27 66.29 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.698 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -31.09 69.81 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -80.21 -49.8 11.14 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 11.6 t -65.82 -45.72 81.27 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.823 HD22 ' O ' ' C' ' 759' ' ' ASP . 0.6 OUTLIER -68.31 -37.5 80.66 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -178.142 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.731 ' H ' HD23 ' C' ' 763' ' ' LEU . 83.5 p -98.36 -49.03 4.83 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.621 0.724 . . . . 0.0 111.663 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 2.4 tt 68.4 55.85 0.5 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.454 1.121 . . . . 0.0 109.273 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . 0.415 ' C ' ' HG ' ' C' ' 767' ' ' SER . 0.1 OUTLIER 61.11 152.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.451 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . 0.415 ' HG ' ' C ' ' C' ' 766' ' ' PHE . 0.1 OUTLIER 55.14 116.32 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.548 0.69 . . . . 0.0 111.709 179.899 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -26.63 68.84 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.734 -0.604 . . . . 0.0 110.82 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -65.52 -43.21 90.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.265 1.031 . . . . 0.0 108.293 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -64.72 -29.9 70.9 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.011 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.719 HD12 ' HB3' ' C' ' 764' ' ' SER . 5.0 tt -59.75 -32.21 70.35 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.475 -0.766 . . . . 0.0 110.395 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -38.22 72.78 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.038 -0.414 . . . . 0.0 110.974 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . 0.602 ' OD2' HD22 ' C' ' 774' ' ' LEU . 4.9 p30 -68.29 -33.9 75.18 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.286 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.602 HD22 ' OD2' ' C' ' 773' ' ' ASP . 4.0 mm? -60.25 -38.2 82.76 Favored 'General case' 0 C--N 1.353 0.746 0 CA-C-O 121.838 0.827 . . . . 0.0 110.113 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.792 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.2 mm? -58.17 -36.28 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.028 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -32.85 64.49 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.689 -0.632 . . . . 0.0 111.579 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.581 HD12 HD13 ' C' ' 774' ' ' LEU . 8.3 mt -64.87 -37.45 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.356 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.792 HG22 ' O ' ' C' ' 775' ' ' LEU . 4.4 m -55.5 -39.72 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 122.075 -0.391 . . . . 0.0 111.751 -177.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 22.5 m -63.3 -48.21 79.04 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.774 -0.579 . . . . 0.0 110.679 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -31.56 71.98 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.486 0.66 . . . . 0.0 110.486 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.499 HG21 ' HB ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -58.2 -36.62 58.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.579 -179.268 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 747' ' ' ARG . 39.9 t -52.74 -38.82 28.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.579 -0.701 . . . . 0.0 109.148 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 . . . . . 0 CA--C 1.543 0.681 0 O-C-N 121.463 -0.773 . . . . 0.0 111.197 177.613 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 tp . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.424 0.63 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.42 HD22 ' CZ2' ' A' ' 666' ' ' TRP . 23.5 mt 54.37 64.02 1.96 Allowed 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.643 0.735 . . . . 0.0 109.49 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . 0.404 ' C ' ' H ' ' A' ' 664' ' ' ASP . 1.5 mm-40 -157.61 73.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.785 HD23 ' N ' ' B' ' 660' ' ' LEU . 2.3 tm? 70.79 -35.4 0.33 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.981 0.912 . . . . 0.0 112.742 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 662' ' ' GLU . 11.7 t0 -91.56 -37.16 13.28 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.006 0.431 . . . . 0.0 111.758 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -81.38 -31.44 33.3 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.149 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . 0.42 ' CZ2' HD22 ' A' ' 661' ' ' LEU . 97.1 m95 -74.46 -39.9 62.23 Favored 'General case' 0 C--N 1.34 0.193 0 O-C-N 121.955 -0.466 . . . . 0.0 111.167 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -76.91 -36.27 56.76 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 57.4 p -58.13 -30.84 66.64 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.165 0.507 . . . . 0.0 110.844 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.514 HD22 ' OG1' ' A' ' 676' ' ' THR . 2.4 mt -63.93 -24.1 67.6 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -64.43 -31.13 72.21 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.83 -0.544 . . . . 0.0 111.107 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -69.45 -30.1 67.94 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.309 0.576 . . . . 0.0 111.032 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -57.48 -48.98 77.77 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.503 0.668 . . . . 0.0 110.374 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 t80 53.96 32.12 14.76 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.72 0.771 . . . . 0.0 110.829 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -146.79 -68.59 0.26 Allowed 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.702 -0.624 . . . . 0.0 111.715 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.665 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.2 OUTLIER -68.16 -39.83 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 CA-C-O 121.418 0.628 . . . . 0.0 111.953 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.514 ' OG1' HD22 ' A' ' 669' ' ' LEU . 17.4 m -52.81 -33.8 50.79 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -62.55 -50.15 72.48 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.874 -0.516 . . . . 0.0 111.783 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.708 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.9 t-105 -65.53 -45.58 82.89 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.649 -0.657 . . . . 0.0 110.379 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.416 HD21 HH11 ' C' ' 683' ' ' ARG . 0.1 OUTLIER -67.22 -35.1 78.87 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -86.29 -11.16 53.0 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.784 -0.573 . . . . 0.0 111.933 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -103.81 -21.87 13.61 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -61.17 -35.46 65.92 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 CA-C-N 120.729 1.604 . . . . 0.0 111.216 179.058 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 16.0 mmm-85 -52.95 -41.52 64.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.799 0.809 . . . . 0.0 109.618 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 88.4 mt -78.52 -40.91 24.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 CA-C-O 122.078 0.942 . . . . 0.0 109.305 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -27.61 68.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.442 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.75 -45.37 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.85 -37.31 71.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.99 -37.55 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.65 -42.7 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . 0.458 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -54.74 -38.9 65.41 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.7 m -67.01 -38.85 86.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.697 0.76 . . . . 0.0 109.48 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -46.24 89.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.919 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.687 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.3 OUTLIER -57.9 -41.7 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.837 -179.173 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.93 -31.25 80.18 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.452 ' O ' HG12 ' A' ' 698' ' ' VAL . 2.4 tt -60.03 -40.54 89.69 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.92 0.866 . . . . 0.0 110.031 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.2 mmm180 -55.53 -28.19 53.32 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.88 0.872 . . . . 0.0 112.112 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 45.3 mm -58.05 -35.33 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.52 -0.738 . . . . 0.0 109.624 -177.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.694 ' O ' HG22 ' A' ' 701' ' ' VAL . 3.3 p -54.02 -28.65 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 121.784 -0.572 . . . . 0.0 110.221 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 19.4 m-85 -54.55 -28.48 46.06 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.83 -0.544 . . . . 0.0 110.651 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.94 -37.42 71.49 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.4 m -67.29 -35.95 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -38.2 87.35 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.032 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 69.9 m -67.26 -40.92 86.27 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.248 0.546 . . . . 0.0 109.851 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.776 HD23 ' HD2' ' A' ' 707' ' ' ARG . 13.1 mt -64.91 -42.68 94.53 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-O 121.784 0.802 . . . . 0.0 109.331 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.581 HG23 ' CB ' ' A' ' 748' ' ' LEU . 0.5 OUTLIER -63.56 -41.49 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.948 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 2.2 m120 -60.93 -44.57 97.04 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.776 ' HD2' HD23 ' A' ' 704' ' ' LEU . 0.0 OUTLIER -64.94 -35.76 82.22 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.853 0.835 . . . . 0.0 110.575 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.0 t -75.59 -45.44 39.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.451 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -74.89 -14.58 60.67 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.8 OUTLIER -83.09 6.97 17.25 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.035 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.63 27.8 Favored Glycine 0 CA--C 1.539 1.57 0 O-C-N 122.024 -0.422 . . . . 0.0 113.17 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.6 -143.41 0.45 Allowed 'General case' 0 CA--C 1.56 1.351 0 O-C-N 121.738 -0.86 . . . . 0.0 110.435 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.468 ' HB2' HG21 ' C' ' 708' ' ' VAL . 81.7 p -62.12 159.7 36.32 Favored Pre-proline 0 C--N 1.351 0.667 0 O-C-N 121.293 -0.88 . . . . 0.0 110.682 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -41.57 104.56 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.585 1.523 . . . . 0.0 112.576 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.611 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.1 pt? -108.82 -20.57 13.02 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -177.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 121.536 0.684 . . . . 0.0 110.682 -179.442 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.311 1.053 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -57.93 -25.09 60.44 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.873 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.34 -9.86 0.33 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -175.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.65 -31.86 70.19 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.366 -0.834 . . . . 0.0 109.151 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -69.59 -45.06 69.5 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -71.11 -31.8 68.22 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.839 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 84.2 p -61.31 -42.57 98.89 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.718 HG22 HD13 ' C' ' 781' ' ' ILE . 48.3 mt -57.65 -16.49 5.81 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -58.46 -25.28 62.09 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.96 -1.088 . . . . 0.0 108.87 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 748' ' ' LEU . 0.5 OUTLIER -60.49 -14.76 21.32 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -54.33 -54.18 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.725 0 CA-C-N 121.4 1.909 . . . . 0.0 105.882 178.784 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -72.81 -20.43 61.14 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.074 -1.875 . . . . 0.0 110.993 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -57.31 -20.96 38.5 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.04 -178.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 7.2 m -61.46 -40.56 94.95 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.887 -0.772 . . . . 0.0 110.084 179.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.6 -50.87 40.4 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.56 0.695 . . . . 0.0 109.802 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.18 -34.83 78.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.176 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.501 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.4 tt -59.5 -45.44 91.69 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.904 -0.497 . . . . 0.0 110.619 -177.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.0 mm -64.93 -34.8 72.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.725 0.774 . . . . 0.0 109.326 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -33.93 75.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.627 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.444 ' OD1' HD23 ' B' ' 715' ' ' LEU . 3.7 m-20 -57.26 -43.05 82.67 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.353 -0.842 . . . . 0.0 109.343 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -70.35 -44.33 68.38 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.664 0.745 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.522 ' HA ' HD11 ' A' ' 763' ' ' LEU . 12.9 mt -65.08 -32.55 74.31 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.651 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -82.39 -22.55 35.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -46.94 24.44 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.321 -0.862 . . . . 0.0 111.675 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -69.13 -53.4 20.38 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.514 -0.741 . . . . 0.0 111.899 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . 0.471 ' H ' HD12 ' A' ' 763' ' ' LEU . 10.0 p -97.79 -49.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.482 -0.761 . . . . 0.0 112.454 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.449 ' O ' HD23 ' A' ' 765' ' ' LEU . 0.6 OUTLIER 75.94 -7.64 1.77 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.984 0.514 . . . . 0.0 111.036 -178.001 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -174.95 121.42 0.22 Allowed 'General case' 0 C--N 1.347 0.493 0 O-C-N 121.346 -0.846 . . . . 0.0 110.985 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 67.1 m 48.96 -96.71 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.402 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.781 ' CE1' HD23 ' A' ' 771' ' ' LEU . 21.7 t80 -166.68 -21.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.243 -0.911 . . . . 0.0 112.252 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -52.43 -37.44 56.8 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.406 0.622 . . . . 0.0 110.385 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -70.31 -30.59 67.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.372 0.606 . . . . 0.0 111.029 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.781 HD23 ' CE1' ' A' ' 768' ' ' TYR . 0.2 OUTLIER -60.61 -34.2 73.88 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.234 0.54 . . . . 0.0 109.926 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 -41.78 77.87 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -65.76 -34.48 78.27 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.976 HD22 HD11 ' A' ' 777' ' ' ILE . 0.4 OUTLIER -58.24 -38.81 77.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.337 0.589 . . . . 0.0 110.489 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 778' ' ' VAL . 6.6 tp -59.52 -36.96 77.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.235 0.54 . . . . 0.0 112.239 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . 0.519 ' C ' HD13 ' A' ' 776' ' ' LEU . 2.4 tm? -74.69 -42.45 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.631 -0.668 . . . . 0.0 111.634 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.976 HD11 HD22 ' A' ' 774' ' ' LEU . 29.2 pt -65.21 -35.93 76.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.502 ' O ' ' HB ' ' A' ' 781' ' ' ILE . 17.5 m -54.55 -38.95 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.954 0.797 . . . . 0.0 110.171 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 17.8 p -63.07 -35.91 81.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 118.447 -1.301 . . . . 0.0 108.041 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -32.01 72.31 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.681 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 746' ' ' ILE . 0.7 OUTLIER -57.54 -55.7 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.4 m -64.35 -38.89 83.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.594 0.711 . . . . 0.0 111.066 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.15 -41.64 97.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.602 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.91 -43.42 83.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.223 0.535 . . . . 0.0 111.231 -178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.586 HD23 ' ND2' ' B' ' 750' ' ' ASN . 2.0 tp . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 120.966 0.412 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.785 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.6 tp . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.453 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.9 mm? 58.05 106.31 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.315 0.579 . . . . 0.0 110.196 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.15 177.97 4.6 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.939 0.876 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.498 ' C ' HD23 ' B' ' 663' ' ' LEU . 10.1 tt -46.19 -53.76 9.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.691 0.758 . . . . 0.0 111.48 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -65.41 -29.61 70.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.578 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -76.45 -44.4 35.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.913 0.387 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -59.08 -46.1 89.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.634 0.73 . . . . 0.0 110.085 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.08 -21.64 66.61 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.228 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 4.9 m -70.35 -36.25 74.09 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.822 -0.549 . . . . 0.0 111.217 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.581 HD12 ' CG2' ' B' ' 675' ' ' ILE . 3.5 mm? -60.74 -23.82 65.24 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.992 -0.443 . . . . 0.0 111.196 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -59.86 -23.02 63.07 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.764 -0.585 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -88.14 -27.73 21.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.123 0.487 . . . . 0.0 111.265 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -57.44 -50.87 71.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.528 0.68 . . . . 0.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.64 29.94 14.99 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.136 0.494 . . . . 0.0 111.269 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -144.11 -61.47 0.39 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.671 -0.643 . . . . 0.0 111.075 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.581 ' CG2' HD12 ' B' ' 669' ' ' LEU . 5.9 tp -67.92 -37.78 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 121.323 0.582 . . . . 0.0 110.33 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.8 m -52.98 -34.55 56.56 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.758 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -69.16 -50.47 47.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.886 -0.509 . . . . 0.0 111.368 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.74 -42.17 95.4 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.0 tp -65.97 -35.74 81.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.94 0.4 . . . . 0.0 110.859 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -101.27 6.56 42.92 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.58 -21.15 9.29 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 121.71 -0.619 . . . . 0.0 110.471 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 tp -62.16 -35.53 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.771 0.796 . . . . 0.0 109.982 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -53.21 -47.36 69.0 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.622 -0.674 . . . . 0.0 109.972 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.443 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.8 mp -69.21 -37.91 76.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 122.246 1.022 . . . . 0.0 108.394 177.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' B' ' 689' ' ' VAL . 11.9 t80 -59.73 -33.89 72.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.674 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.5 ' CG2' HD12 ' C' ' 686' ' ' ILE . 1.4 mp -60.49 -41.98 89.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 86.2 mt -62.41 -36.95 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.15 -37.54 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.529 ' O ' HD11 ' B' ' 692' ' ' LEU . 93.3 t -54.12 -38.79 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 O-C-N 121.723 -0.611 . . . . 0.0 109.447 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.64 -27.15 57.61 Favored Glycine 0 CA--C 1.546 1.995 0 O-C-N 121.902 -0.499 . . . . 0.0 112.078 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.7 m -60.77 -47.12 87.76 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.613 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.7 -32.59 70.65 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.528 -0.733 . . . . 0.0 111.482 -178.004 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.613 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.37 -41.66 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 O-C-N 121.605 -0.684 . . . . 0.0 109.662 -178.527 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.94 -32.17 83.34 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.84 -37.08 63.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.3 1.048 . . . . 0.0 109.345 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.63 ' HG3' HD11 ' A' ' 693' ' ' ILE . 26.6 mmt180 -55.58 -28.28 54.12 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.692 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 79.2 mt -58.77 -36.21 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 O-C-N 121.423 -0.798 . . . . 0.0 108.914 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -30.29 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 O-C-N 121.674 -0.641 . . . . 0.0 110.123 177.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 5.5 m-85 -56.36 -31.01 63.38 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 121.828 -0.545 . . . . 0.0 109.871 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.89 -37.57 76.89 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.86 -40.59 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.167 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 176.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.3 tp -55.6 -37.21 67.82 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.975 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.5 m -62.37 -40.77 97.51 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.178 0.513 . . . . 0.0 110.821 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.78 -41.05 94.79 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.069 0.938 . . . . 0.0 109.265 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.649 ' HA ' HD13 ' B' ' 748' ' ' LEU . 89.8 t -69.68 -43.57 80.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.556 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HB2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.77 -36.41 82.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.078 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -67.19 -47.75 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.151 -0.968 . . . . 0.0 110.375 -178.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.555 ' CG1' HD11 ' B' ' 748' ' ' LEU . 2.6 t -77.12 -46.29 28.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -73.8 -43.17 59.63 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' B' ' 706' ' ' ASN . 31.5 mt-30 -102.01 -21.58 14.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -175.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . 0.444 ' HA3' HD11 ' B' ' 715' ' ' LEU . . . 109.43 136.32 7.53 Favored Glycine 0 CA--C 1.534 1.235 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . 0.679 ' O ' HD22 ' A' ' 704' ' ' LEU . 2.1 p90 -75.4 -67.89 0.61 Allowed 'General case' 0 CA--C 1.557 1.24 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 1.7 p -65.54 159.6 66.42 Favored Pre-proline 0 N--CA 1.47 0.535 0 O-C-N 120.628 -1.295 . . . . 0.0 110.516 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -37.57 133.11 0.62 Allowed 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.996 1.798 . . . . 0.0 111.847 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.516 HD22 ' N ' ' B' ' 715' ' ' LEU . 2.0 mm? -94.16 -20.35 19.95 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.503 ' C ' ' O ' ' B' ' 715' ' ' LEU . 97.3 p . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 122.279 1.037 . . . . 0.0 112.819 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 121.47 0.653 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -71.03 -26.61 63.18 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.298 0.57 . . . . 0.0 111.284 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -56.23 -7.03 0.31 Allowed 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.447 ' O ' HG13 ' B' ' 746' ' ' ILE . 3.6 ttm180 -55.73 -38.99 70.51 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.515 -0.741 . . . . 0.0 110.912 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -58.54 -43.94 89.45 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.339 0.59 . . . . 0.0 109.664 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -71.42 -39.78 70.87 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.141 0.496 . . . . 0.0 110.468 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.84 -23.76 46.32 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.982 HG23 HG23 ' A' ' 781' ' ' ILE . 48.6 mt -52.43 -32.47 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.36 67.57 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.165 0.507 . . . . 0.0 110.452 179.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.649 HD13 ' HA ' ' B' ' 705' ' ' VAL . 45.4 mt -56.24 -35.7 67.67 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.497 0.555 . . . . 0.0 112.497 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.48 -54.11 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.586 ' ND2' HD23 ' A' ' 785' ' ' LEU . 4.4 m-80 -72.46 -18.77 61.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.668 0.746 . . . . 0.0 110.073 175.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.4 37.26 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.377 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 83.8 p -59.21 -39.65 83.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 117.787 0.793 . . . . 0.0 110.052 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.0 tp -69.66 -51.17 37.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.8 0.81 . . . . 0.0 109.649 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.13 73.27 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.408 0.623 . . . . 0.0 111.366 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.494 HD21 HE22 ' C' ' 710' ' ' GLN . 10.5 tt -59.76 -45.2 92.97 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 120.976 0.417 . . . . 0.0 110.787 -178.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 53.7 mt -70.4 -33.7 55.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.5 0.667 . . . . 0.0 109.55 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.1 -30.28 68.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.754 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -55.61 -47.97 75.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.409 -0.807 . . . . 0.0 110.086 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -70.73 -45.25 65.22 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.1 mt -69.23 -46.28 67.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.653 0.74 . . . . 0.0 112.535 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -69.06 -40.12 78.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.682 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 15.4 t -63.92 -45.1 90.77 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.911 0.862 . . . . 0.0 110.599 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.612 ' O ' HD22 ' B' ' 774' ' ' LEU . 3.6 tp -63.83 -51.84 62.88 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.872 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.1 -49.23 5.07 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.878 -0.514 . . . . 0.0 111.922 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . 0.536 HD13 ' O ' ' B' ' 765' ' ' LEU . 3.4 tm? 69.45 93.54 0.08 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 122.22 1.009 . . . . 0.0 109.81 -178.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 58.6 t80 56.54 -88.51 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.915 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.2 m -67.96 134.76 51.31 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.283 -0.886 . . . . 0.0 111.246 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.6 -33.95 69.46 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.001 0.429 . . . . 0.0 109.981 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -54.46 -38.49 66.43 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.154 0.978 . . . . 0.0 108.956 178.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.85 -29.6 60.12 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.452 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.426 HD11 HD23 ' B' ' 763' ' ' LEU . 7.3 tt -59.25 -41.28 88.39 Favored 'General case' 0 C--N 1.343 0.296 0 O-C-N 121.794 -0.566 . . . . 0.0 109.841 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . 0.407 ' O ' HD12 ' B' ' 776' ' ' LEU . 70.8 mtp85 -59.95 -39.47 85.67 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -64.22 -45.65 87.31 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.235 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.612 HD22 ' O ' ' B' ' 763' ' ' LEU . 5.9 mp -66.6 -37.8 85.65 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 121.835 0.826 . . . . 0.0 110.262 178.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.527 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -62.83 -36.65 83.92 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.646 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . 0.407 HD12 ' O ' ' B' ' 772' ' ' ARG . 0.3 OUTLIER -73.67 -42.21 61.64 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.848 -0.533 . . . . 0.0 111.996 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.89 -37.44 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 121.634 -0.666 . . . . 0.0 110.468 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 13.1 p -63.32 -44.99 99.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.886 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.775 ' O ' HG22 ' B' ' 782' ' ' VAL . 7.2 t -64.06 -35.72 81.67 Favored 'General case' 0 C--N 1.351 0.642 0 O-C-N 121.577 -0.702 . . . . 0.0 111.125 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -31.47 71.94 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.983 -0.448 . . . . 0.0 111.622 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 76.5 mt -67.88 -36.78 76.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 O-C-N 121.759 -0.588 . . . . 0.0 110.907 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.775 HG22 ' O ' ' B' ' 779' ' ' THR . 6.9 m -61.07 -39.0 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.852 -0.53 . . . . 0.0 111.984 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.4 -41.58 93.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.628 -0.67 . . . . 0.0 111.043 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.0 -42.17 99.78 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.619 0.723 . . . . 0.0 110.174 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.433 HD23 ' HB3' ' C' ' 750' ' ' ASN . 15.0 tp -82.36 -17.38 45.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.413 0.625 . . . . 0.0 111.624 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.37 -46.09 22.22 Favored Glycine 0 CA--C 1.531 1.074 0 O-C-N 121.797 -0.564 . . . . 0.0 112.16 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 95.5 5.29 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.488 0.661 . . . . 0.0 110.524 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.127 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.499 HD12 ' C ' ' C' ' 660' ' ' LEU . 4.0 pp . . . . . 0 N--CA 1.496 1.827 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.0 143.28 50.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.267 0.556 . . . . 0.0 110.63 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -172.44 176.44 3.3 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.086 0.469 . . . . 0.0 110.05 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 20.7 tp -54.59 -44.0 72.64 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.767 0.794 . . . . 0.0 109.957 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.88 -33.52 76.22 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.778 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -79.19 -40.32 31.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.185 0.517 . . . . 0.0 110.736 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -70.78 -46.33 63.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 110.318 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.72 -22.26 66.59 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.442 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 36.3 t -68.1 -35.56 78.36 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.1 0.476 . . . . 0.0 111.441 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -34.47 73.35 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.117 0.484 . . . . 0.0 111.197 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 64.9 m95 -59.83 -27.93 67.04 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.117 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -77.73 -20.1 54.07 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.081 -0.387 . . . . 0.0 112.033 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -67.46 -45.07 77.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.673 0.749 . . . . 0.0 110.348 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 53.89 29.26 9.6 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.028 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.05 -75.8 0.24 Allowed 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.49 -0.756 . . . . 0.0 112.497 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.674 HD13 ' CZ3' ' C' ' 678' ' ' TRP . 0.6 OUTLIER -68.23 -36.67 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.62 -0.675 . . . . 0.0 111.221 -178.571 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 25.3 m -51.62 -33.09 31.58 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.16 -0.337 . . . . 0.0 110.963 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -56.33 -47.89 77.85 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.674 ' CZ3' HD13 ' C' ' 675' ' ' ILE . 0.0 OUTLIER -64.87 -43.43 92.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 177.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.51 ' O ' HD23 ' C' ' 679' ' ' LEU . 0.9 OUTLIER -58.87 -40.14 83.49 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -97.71 -40.39 8.6 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -69.18 -19.79 63.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.704 -0.623 . . . . 0.0 112.015 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.67 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.2 pp -60.63 -36.7 72.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.67 ' N ' HD12 ' C' ' 682' ' ' ILE . 1.6 ttt-85 -53.69 -45.21 70.29 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 121.861 0.839 . . . . 0.0 109.023 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.3 mm -62.38 -43.13 97.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 122.4 1.095 . . . . 0.0 108.898 177.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.534 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.7 OUTLIER -60.47 -27.59 67.67 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.125 -178.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.5 HD12 ' CG2' ' B' ' 686' ' ' ILE . 16.5 mm -60.11 -46.48 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.974 -0.454 . . . . 0.0 109.889 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.02 -41.4 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.511 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.2 mt -59.79 -37.59 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.951 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.534 HG23 ' O ' ' C' ' 685' ' ' PHE . 79.6 t -54.78 -45.32 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.33 -38.76 62.96 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -37.93 84.65 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 122.09 0.948 . . . . 0.0 109.824 177.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.23 -46.29 88.87 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 113.166 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -61.3 -41.82 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.401 -0.812 . . . . 0.0 109.415 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.95 73.15 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.407 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.4 tt -54.87 -37.66 66.55 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.559 -0.965 . . . . 0.0 110.196 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.91 -28.68 57.89 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 -177.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -36.85 62.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-N 121.338 1.881 . . . . 0.0 111.183 -175.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.4 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.8 p -62.55 -30.26 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.448 -0.782 . . . . 0.0 111.014 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -56.29 -31.12 63.36 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.75 -0.594 . . . . 0.0 110.04 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.18 -37.79 78.24 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -43.64 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tp -61.24 -37.71 84.06 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.209 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 61.9 m -62.52 -36.23 81.94 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.374 0.607 . . . . 0.0 110.371 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -62.91 -47.01 85.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.483 1.135 . . . . 0.0 108.494 178.544 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.72 -44.26 98.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.783 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -62.57 -35.79 80.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.281 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -61.32 -50.28 73.59 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.473 -0.767 . . . . 0.0 110.655 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' A' ' 713' ' ' SER . 0.6 OUTLIER -77.33 -45.02 30.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.824 0.821 . . . . 0.0 111.782 -178.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -73.83 -33.37 64.12 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.494 HE22 HD21 ' B' ' 755' ' ' LEU . 7.4 tt0 -102.17 -15.49 16.65 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 91.83 133.73 6.12 Favored Glycine 0 CA--C 1.542 1.751 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -87.7 -36.72 17.23 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.764 -0.845 . . . . 0.0 113.102 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.53 149.35 35.65 Favored Pre-proline 0 N--CA 1.469 0.483 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.961 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . 0.443 ' CD ' HG21 ' B' ' 708' ' ' VAL . 16.9 Cg_exo -36.71 92.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.501 2.134 . . . . 0.0 112.704 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.97 11.03 1.94 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.492 0.663 . . . . 0.0 110.903 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -72.67 -38.31 67.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.328 0.585 . . . . 0.0 111.528 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.57 -7.49 53.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.493 ' O ' HD12 ' C' ' 746' ' ' ILE . 0.0 OUTLIER -65.87 -35.34 80.38 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.695 -0.628 . . . . 0.0 111.411 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -58.04 -41.19 82.74 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 109.786 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.4 68.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-O 121.214 0.531 . . . . 0.0 110.496 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . 0.585 ' O ' HD22 ' C' ' 748' ' ' LEU . 83.8 p -67.04 -43.09 83.64 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.637 -0.665 . . . . 0.0 110.178 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.493 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.8 mp -55.43 -23.9 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.945 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . 0.512 ' HA ' HD21 ' C' ' 750' ' ' ASN . 6.9 mtt180 -60.01 -15.64 24.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.885 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.585 HD22 ' O ' ' C' ' 745' ' ' SER . 1.5 pt? -55.38 -31.77 62.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.972 -0.455 . . . . 0.0 110.949 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.7 t -55.73 -54.9 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.512 HD21 ' HA ' ' C' ' 747' ' ' ARG . 1.1 p30 -72.39 -23.63 61.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.766 0.793 . . . . 0.0 109.761 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.75 -21.76 44.74 Favored Glycine 0 C--N 1.342 0.899 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.012 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 19.3 m -63.07 -42.24 99.62 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.943 -0.739 . . . . 0.0 109.894 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.7 tp -69.32 -44.86 70.85 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.422 0.63 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.78 -35.63 79.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.872 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.447 HD11 ' HG ' ' C' ' 704' ' ' LEU . 8.8 tt -61.33 -45.3 95.02 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.216 0.531 . . . . 0.0 111.241 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 44.7 mm -71.67 -40.99 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.118 0.485 . . . . 0.0 110.38 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.56 -41.11 76.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -55.84 -35.89 66.92 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.346 -0.847 . . . . 0.0 110.54 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -70.37 -45.47 66.0 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.762 0.791 . . . . 0.0 111.156 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 20.8 mt -69.61 -46.07 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.676 0.75 . . . . 0.0 112.249 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . 0.542 ' O ' HD13 ' C' ' 765' ' ' LEU . 1.5 ttp180 -68.81 -27.5 65.92 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.543 -177.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.9 m -63.96 -43.96 94.22 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.447 0.641 . . . . 0.0 111.173 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.73 -54.66 14.76 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 3.0 p -97.86 -18.26 18.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . 0.545 HD22 ' N ' ' C' ' 765' ' ' LEU . 3.3 mm? 49.67 78.86 0.09 Allowed 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.393 -0.817 . . . . 0.0 109.744 -177.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 69.9 t80 65.9 125.0 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.234 1.016 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 23.06 88.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 178.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . 0.437 ' CZ ' HD22 ' C' ' 771' ' ' LEU . 1.1 m-85 22.63 -146.72 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.759 1.223 . . . . 0.0 114.028 176.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 74.26 -64.56 0.38 Allowed 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.201 -0.937 . . . . 0.0 109.398 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.26 69.77 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.098 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' C' ' 768' ' ' TYR . 39.1 tp -59.48 -36.93 76.96 Favored 'General case' 0 C--N 1.348 0.543 0 O-C-N 121.803 -0.561 . . . . 0.0 109.731 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -42.96 82.17 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' C' ' 776' ' ' LEU . 23.6 m-20 -69.38 -34.4 74.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.556 176.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.524 HD13 ' C ' ' C' ' 774' ' ' LEU . 3.3 tm? -61.08 -41.2 96.21 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.749 -0.594 . . . . 0.0 110.868 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.45 -38.3 83.74 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . 0.464 HD12 ' N ' ' C' ' 777' ' ' ILE . 3.3 pp -74.01 -28.45 61.45 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.656 -0.652 . . . . 0.0 111.822 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.464 ' N ' HD12 ' C' ' 776' ' ' LEU . 0.6 OUTLIER -69.26 -39.14 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 O-C-N 121.467 -0.77 . . . . 0.0 110.682 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.702 ' O ' HG22 ' C' ' 781' ' ' ILE . 12.3 m -66.36 -46.35 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.877 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.849 ' O ' HG22 ' C' ' 782' ' ' VAL . 9.8 t -64.21 -37.5 87.71 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.974 -0.454 . . . . 0.0 111.815 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.6 72.59 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.148 -0.345 . . . . 0.0 111.567 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.718 HD13 HG22 ' A' ' 746' ' ' ILE . 8.9 tt -55.03 -39.95 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.546 -0.721 . . . . 0.0 111.233 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.849 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -60.16 -38.29 76.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.276 -0.569 . . . . 0.0 111.917 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 CA--C 1.544 0.723 0 O-C-N 121.708 -0.62 . . . . 0.0 111.531 -178.727 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.663 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.5 tp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.755 0.788 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 76.0 mt 52.75 81.03 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.046 0.927 . . . . 0.0 111.209 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.75 177.82 8.44 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.67 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.3 OUTLIER -54.41 -34.38 61.22 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.253 0.549 . . . . 0.0 110.15 179.444 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -75.79 -35.54 60.04 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -80.1 -41.2 26.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.259 0.552 . . . . 0.0 110.676 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -67.96 -43.62 78.62 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.298 0.57 . . . . 0.0 110.281 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.54 -29.52 63.65 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.722 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 36.7 t -69.77 -30.56 68.16 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 110.745 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.423 HD23 HG23 ' A' ' 676' ' ' THR . 17.8 tp -61.02 -31.5 71.13 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.843 0.354 . . . . 0.0 111.173 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.58 -18.3 39.98 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.921 -0.487 . . . . 0.0 111.702 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -84.02 -16.08 45.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.921 -0.487 . . . . 0.0 111.807 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.6 -50.22 74.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.341 0.591 . . . . 0.0 110.88 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 55.3 t80 56.55 44.42 24.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.005 0.907 . . . . 0.0 110.982 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -153.59 -80.61 0.09 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.8 -0.562 . . . . 0.0 110.561 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 11.2 tt -68.13 -35.71 72.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.841 -0.537 . . . . 0.0 111.973 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.423 HG23 HD23 ' A' ' 669' ' ' LEU . 4.1 m -50.22 -33.34 19.13 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -174.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -63.26 -50.42 70.23 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.331 0.969 . . . . 0.0 109.001 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.411 ' CD1' ' C ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -66.07 -44.37 84.72 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.577 0.704 . . . . 0.0 110.123 177.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.425 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -63.67 -37.08 86.0 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -92.11 -44.51 8.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -73.38 -0.82 15.89 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.44 -36.37 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 121.296 -0.878 . . . . 0.0 109.622 178.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -53.77 -47.58 70.57 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.96 0.41 . . . . 0.0 110.874 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -68.43 -31.98 53.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -33.61 76.19 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 1.036 HD12 HG21 ' C' ' 686' ' ' ILE . 8.9 mm -60.83 -49.51 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 109.991 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.0 mt -61.48 -38.5 80.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.09 -37.16 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.245 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 74.9 t -54.2 -39.65 43.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.7 -41.73 97.6 Favored Glycine 0 CA--C 1.534 1.24 0 N-CA-C 108.961 -1.655 . . . . 0.0 108.961 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -61.77 -37.9 86.04 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.777 0.798 . . . . 0.0 109.766 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.88 -46.09 88.65 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.879 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.624 HG13 HG22 ' B' ' 693' ' ' ILE . 0.3 OUTLIER -68.38 -40.1 81.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.538 179.538 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -26.73 64.07 Favored Glycine 0 CA--C 1.54 1.652 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.41 -37.33 85.39 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.691 1.234 . . . . 0.0 109.332 177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 21.5 mmt180 -55.9 -28.31 56.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.019 -178.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.1 OUTLIER -59.25 -37.12 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.03 -1.043 . . . . 0.0 109.869 -177.225 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.774 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.1 p -67.41 -30.57 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 121.547 -0.721 . . . . 0.0 109.952 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.3 OUTLIER -55.55 -28.79 56.94 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.232 0.539 . . . . 0.0 109.713 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.06 72.01 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.774 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -61.01 -35.93 68.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -38.0 72.81 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.0 m -64.18 -36.7 84.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.748 0.785 . . . . 0.0 109.707 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.569 HD22 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -61.98 -44.11 97.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 122.495 1.14 . . . . 0.0 108.636 178.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.888 HG22 HD12 ' A' ' 748' ' ' LEU . 88.0 t -65.45 -42.03 92.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.484 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -62.61 -37.08 84.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.574 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.569 HH22 HD22 ' A' ' 704' ' ' LEU . 21.4 ttm105 -61.59 -46.93 87.77 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.096 0.951 . . . . 0.0 110.334 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.3 t -75.77 -44.04 39.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.15 0.976 . . . . 0.0 109.833 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.88 -14.89 61.58 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -20.69 18.2 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.297 -0.877 . . . . 0.0 111.962 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.9 24.96 7.03 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.416 ' CD1' ' CZ ' ' C' ' 707' ' ' ARG . 0.1 OUTLIER 59.07 -103.55 0.17 Allowed 'General case' 0 CA--C 1.562 1.406 0 O-C-N 121.956 -0.732 . . . . 0.0 111.559 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 2.2 p -79.39 159.52 72.2 Favored Pre-proline 0 C--N 1.349 0.558 0 O-C-N 120.931 -1.106 . . . . 0.0 110.013 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.511 ' HD3' HD12 ' C' ' 748' ' ' LEU . 72.2 Cg_exo -41.72 110.82 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.574 1.516 . . . . 0.0 112.514 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.94 -18.97 13.56 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 122.072 -0.392 . . . . 0.0 111.797 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.546 0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 111.044 -179.802 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.77 0.795 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -26.52 62.38 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.69 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -13.48 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.603 HH11 HG21 ' C' ' 777' ' ' ILE . 20.0 ttp-105 -73.79 -46.82 43.08 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.358 -0.839 . . . . 0.0 110.148 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.468 ' O ' HG23 ' C' ' 781' ' ' ILE . 1.3 p30 -62.79 -34.68 77.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 122.52 1.152 . . . . 0.0 109.645 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -37.87 70.34 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.645 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.3 t -70.02 -39.7 75.65 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.626 -0.671 . . . . 0.0 112.654 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.797 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -66.36 -41.26 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-O 116.367 -1.778 . . . . 0.0 115.28 -176.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.447 ' HD3' ' HB2' ' A' ' 750' ' ' ASN . 1.6 tmt_? -78.37 -11.51 59.95 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 123.568 2.895 . . . . 0.0 109.212 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.888 HD12 HG22 ' A' ' 705' ' ' VAL . 3.5 tm? -55.78 -20.54 15.32 Favored 'General case' 0 C--N 1.375 1.698 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 172.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.8 p -54.67 -50.41 60.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 177.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.447 ' HB2' ' HD3' ' A' ' 747' ' ' ARG . 1.3 m-80 -71.99 -28.17 63.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.522 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.4 -18.65 22.92 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.409 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 77.6 p -56.63 -36.77 69.85 Favored 'General case' 0 C--N 1.347 0.458 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 33.7 tp -61.53 -47.96 83.19 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.74 -34.59 71.54 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.768 178.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.46 HD22 HG12 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -59.01 -44.68 91.72 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.725 -0.61 . . . . 0.0 111.38 -177.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.36 -32.63 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.43 -30.67 68.65 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.019 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 4.4 m-20 -58.02 -46.99 84.4 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.94 0.876 . . . . 0.0 108.814 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.71 -42.24 70.86 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.505 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 19.3 mt -68.25 -33.39 74.3 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -70.65 -27.43 64.03 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 m -75.82 -45.35 36.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.544 0.688 . . . . 0.0 110.819 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.64 ' HA ' HD13 ' A' ' 774' ' ' LEU . 7.0 mp -68.5 -56.79 7.16 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.41 -49.53 4.21 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.085 0.945 . . . . 0.0 112.301 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.467 ' C ' HD13 ' A' ' 765' ' ' LEU . 2.9 tm? 91.32 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.354 1.462 . . . . 0.0 110.626 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -114.11 -68.07 0.95 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.648 -0.657 . . . . 0.0 111.266 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 24.8 p -91.45 158.8 16.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -78.31 -18.26 55.46 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.122 0.487 . . . . 0.0 111.015 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -72.36 -35.3 68.48 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.589 0.709 . . . . 0.0 109.345 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -57.85 -30.02 65.45 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.243 0.544 . . . . 0.0 110.68 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -34.82 73.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -56.84 -37.58 71.47 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.599 0.714 . . . . 0.0 109.582 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.31 -48.58 72.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.83 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.683 HD12 ' NE ' ' B' ' 742' ' ' ARG . 5.8 tt -60.52 -38.48 84.53 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.653 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.59 -36.97 74.83 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.4 -0.813 . . . . 0.0 110.641 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.23 -45.31 48.91 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.99 -0.444 . . . . 0.0 112.069 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.31 -37.25 79.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.685 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.447 HG22 HG12 ' B' ' 746' ' ' ILE . 38.5 t -56.28 -46.79 81.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.795 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.2 p -64.13 -35.37 80.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.606 0.717 . . . . 0.0 109.854 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -65.3 -38.4 90.08 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.129 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.407 ' CD1' HD13 ' B' ' 746' ' ' ILE . 78.4 mt -59.29 -37.07 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 O-C-N 122.078 -0.389 . . . . 0.0 111.399 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.795 HG22 ' O ' ' A' ' 779' ' ' THR . 5.7 m -54.39 -38.34 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 121.331 -0.856 . . . . 0.0 110.431 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -64.57 -42.51 95.61 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.399 0.619 . . . . 0.0 110.768 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.22 -43.94 69.63 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.399 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.601 HD22 ' ND2' ' B' ' 750' ' ' ASN . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.633 0 O-C-N 121.861 -0.525 . . . . 0.0 111.057 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.67 ' N ' HD12 ' A' ' 663' ' ' LEU . 10.6 mt . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.564 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.4 mm? 60.25 110.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.342 0.591 . . . . 0.0 110.239 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -177.2 169.4 2.29 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.633 HD12 HD13 ' C' ' 660' ' ' LEU . 3.4 tt -51.21 -38.6 53.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.402 0.62 . . . . 0.0 110.552 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -70.96 -37.16 72.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.336 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -70.31 -47.85 59.3 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.364 0.602 . . . . 0.0 110.775 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -60.22 -45.4 93.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.435 0.636 . . . . 0.0 110.182 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.8 -25.68 65.71 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.311 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.29 -37.75 88.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.216 0.531 . . . . 0.0 111.136 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 45.0 mt -60.13 -30.28 69.18 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.015 0.436 . . . . 0.0 111.718 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -59.56 -25.15 64.31 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.211 0.529 . . . . 0.0 110.695 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -81.14 -22.03 39.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.091 0.472 . . . . 0.0 111.328 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -70.01 -49.69 48.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.649 0.737 . . . . 0.0 110.702 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.6 t80 59.78 49.69 7.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.02 0.914 . . . . 0.0 111.031 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -158.21 -70.37 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.867 -0.52 . . . . 0.0 110.855 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.19 -37.18 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.129 0.49 . . . . 0.0 110.912 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.34 -33.74 44.13 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -65.28 -50.86 64.13 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 121.495 -0.753 . . . . 0.0 110.753 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.753 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.2 t90 -65.84 -44.03 86.75 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.854 0.835 . . . . 0.0 109.094 177.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.65 -35.73 81.5 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.25 -28.1 12.83 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -82.6 -6.04 59.13 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.432 -0.792 . . . . 0.0 112.155 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.753 HG23 ' O ' ' B' ' 678' ' ' TRP . 3.3 pt -60.88 -36.74 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.782 -0.574 . . . . 0.0 111.038 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.39 -47.08 69.82 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.075 0.464 . . . . 0.0 110.291 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -68.99 -34.0 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.4 OUTLIER -60.56 -27.62 67.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.38 179.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.797 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -60.75 -45.53 97.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.256 0.55 . . . . 0.0 109.537 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 71.6 mt -62.63 -40.87 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' B' ' 685' ' ' PHE . 32.6 mt -58.61 -37.53 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.47 ' O ' HD12 ' B' ' 692' ' ' LEU . 62.8 t -57.77 -43.35 83.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.63 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.71 -26.71 47.4 Favored Glycine 0 CA--C 1.544 1.845 0 O-C-N 121.579 -0.701 . . . . 0.0 111.926 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 18.6 m -60.52 -45.82 92.41 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.47 HD12 ' O ' ' B' ' 689' ' ' VAL . 0.0 OUTLIER -59.62 -32.61 70.58 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 119.674 1.124 . . . . 0.0 111.586 -177.565 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.624 HG22 HG13 ' A' ' 693' ' ' ILE . 0.9 OUTLIER -57.42 -44.98 85.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.579 -0.701 . . . . 0.0 109.628 -178.187 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.09 67.66 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.422 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.8 OUTLIER -60.17 -37.4 80.04 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.018 0.913 . . . . 0.0 110.424 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.5 ' N ' ' HD2' ' B' ' 696' ' ' ARG . 8.4 mpt_? -54.85 -28.48 50.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.077 0.951 . . . . 0.0 113.259 -178.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -36.4 62.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 O-C-N 120.953 -1.092 . . . . 0.0 109.204 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.422 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.25 -30.22 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 121.499 -0.751 . . . . 0.0 110.413 177.379 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 6.6 m-85 -56.29 -31.09 63.33 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 121.861 -0.524 . . . . 0.0 109.861 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.67 77.23 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -42.15 89.63 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.3 tp -58.64 -38.76 78.8 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.423 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -62.92 -35.17 79.21 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.375 0.607 . . . . 0.0 110.414 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -42.32 95.0 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 122.191 0.996 . . . . 0.0 108.965 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.476 HG22 HD13 ' B' ' 748' ' ' LEU . 72.0 t -66.77 -45.17 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 122.192 0.996 . . . . 0.0 108.783 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.458 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.4 m-80 -62.86 -36.43 83.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.419 ' CZ ' ' HG2' ' C' ' 707' ' ' ARG . 23.2 ttm180 -69.0 -50.13 51.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.741 0.781 . . . . 0.0 111.151 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' C' ' 713' ' ' SER . 1.0 OUTLIER -77.95 -44.67 28.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.148 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -59.75 -45.69 91.43 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.597 ' O ' HD12 ' B' ' 715' ' ' LEU . 3.8 pt20 -105.08 -24.11 12.83 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 140.41 164.96 10.11 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -98.5 -65.49 0.96 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.899 -0.765 . . . . 0.0 111.511 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 38.6 p -72.56 159.47 85.28 Favored Pre-proline 0 CA--C 1.532 0.282 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.299 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.593 ' HB3' HD23 ' A' ' 748' ' ' LEU . 38.5 Cg_exo -34.59 125.02 0.19 Allowed 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.269 1.979 . . . . 0.0 113.352 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.597 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.2 tt -87.5 -20.4 26.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.42 ' C ' ' O ' ' B' ' 715' ' ' LEU . 27.2 t . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 122.131 0.967 . . . . 0.0 113.175 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.16 0.981 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -57.93 -26.33 62.1 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.401 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.4 -8.67 0.36 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.683 ' NE ' HD12 ' A' ' 774' ' ' LEU . 4.8 ptt-85 -78.18 -26.65 47.73 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.296 -0.877 . . . . 0.0 111.453 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -58.14 -45.89 86.6 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.97 -0.456 . . . . 0.0 110.095 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.97 -34.76 69.22 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.245 0.545 . . . . 0.0 109.991 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -56.79 -33.7 66.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.357 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.447 HG12 HG22 ' A' ' 778' ' ' VAL . 0.8 OUTLIER -55.63 -17.95 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.37 177.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.461 ' HG3' HD21 ' A' ' 785' ' ' LEU . 15.5 ttm180 -58.81 -25.81 63.52 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.507 ' C ' HD12 ' B' ' 748' ' ' LEU . 4.4 pp -55.43 -23.29 24.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.009 0.433 . . . . 0.0 110.593 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 746' ' ' ILE . 74.7 t -55.41 -53.93 30.62 Favored 'Isoleucine or valine' 0 C--N 1.348 0.537 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.601 ' ND2' HD22 ' A' ' 785' ' ' LEU . 5.0 m-80 -72.22 -20.11 61.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.355 176.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.45 -20.52 37.91 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 16.3 m -59.04 -41.83 88.8 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 121.871 -0.782 . . . . 0.0 109.804 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -65.78 -50.5 64.48 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.552 0.692 . . . . 0.0 110.09 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.41 -35.4 79.1 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.188 0.518 . . . . 0.0 111.641 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.426 HD21 HE22 ' C' ' 710' ' ' GLN . 7.1 tt -59.6 -45.3 92.32 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.909 -0.495 . . . . 0.0 110.857 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 60.0 mt -63.61 -36.56 76.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.808 0.813 . . . . 0.0 108.857 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -30.28 69.13 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.584 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 95.6 m-20 -55.34 -49.4 72.33 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.715 0.769 . . . . 0.0 109.817 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -70.53 -44.69 67.01 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.0 -29.68 70.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -82.05 -45.47 15.23 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -42.68 65.13 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.683 0.754 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.466 HD23 HD11 ' B' ' 771' ' ' LEU . 1.3 tp -60.83 -53.84 52.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.488 -178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.4 p -97.89 -49.48 4.78 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.427 0.632 . . . . 0.0 112.112 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.0 tt 64.9 104.86 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.995 0.902 . . . . 0.0 111.711 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.41 -76.06 0.06 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.84 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 13.3 m -112.78 172.14 7.11 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.429 -0.794 . . . . 0.0 112.071 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -37.54 30.17 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.116 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -53.08 -38.99 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.275 1.036 . . . . 0.0 109.027 178.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 18.7 tpt85 -61.13 -29.76 69.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.007 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.466 HD11 HD23 ' B' ' 763' ' ' LEU . 10.4 tt -59.75 -33.08 71.2 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.854 -0.529 . . . . 0.0 110.537 -178.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -56.66 -32.89 65.82 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -47.67 85.32 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.669 HD12 ' HE ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.723 0.773 . . . . 0.0 110.142 179.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.587 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.9 OUTLIER -62.68 -43.07 99.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.085 0.469 . . . . 0.0 111.046 -178.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 65.2 mt -74.01 -41.15 62.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 1.9 pp -70.26 -37.22 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 121.765 -0.585 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.537 HG23 ' O ' ' B' ' 774' ' ' LEU . 40.7 t -61.25 -46.08 97.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.503 -0.748 . . . . 0.0 109.786 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.833 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.0 t -63.77 -41.99 97.87 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 121.766 -0.583 . . . . 0.0 112.085 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -31.86 72.12 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.84 -0.537 . . . . 0.0 111.756 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.73 -36.47 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 122.03 -0.419 . . . . 0.0 110.754 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.833 HG22 ' O ' ' B' ' 779' ' ' THR . 8.9 m -54.06 -38.26 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.572 -0.705 . . . . 0.0 109.908 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -61.22 -41.86 97.6 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.561 0.696 . . . . 0.0 110.425 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.14 -44.06 80.78 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.708 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.873 HD23 ' ND2' ' C' ' 750' ' ' ASN . 27.9 tp -82.88 -13.96 55.15 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.293 0.568 . . . . 0.0 111.351 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.99 -42.41 60.66 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.98 133.19 41.98 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.607 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.633 HD13 HD12 ' B' ' 663' ' ' LEU . 4.3 pp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.43 0.633 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.515 HD22 ' N ' ' C' ' 661' ' ' LEU . 3.3 mm? -113.13 152.6 29.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.344 0.592 . . . . 0.0 109.581 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -167.61 158.11 10.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.319 0.58 . . . . 0.0 109.719 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.663 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -53.18 -53.62 47.88 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 122.135 0.969 . . . . 0.0 109.62 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.581 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -66.76 -18.53 65.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.062 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -81.12 -48.44 12.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.062 0.458 . . . . 0.0 110.495 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.451 ' CZ2' HD12 ' C' ' 661' ' ' LEU . 74.6 m95 -56.6 -46.42 80.88 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.28 0.562 . . . . 0.0 110.338 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.11 -25.67 67.11 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.325 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -35.64 81.54 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 122.077 -0.389 . . . . 0.0 111.463 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.5 -35.92 77.09 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.224 0.535 . . . . 0.0 111.424 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -59.91 -26.74 66.16 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.129 0.49 . . . . 0.0 110.826 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -74.09 -34.38 63.96 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.233 0.54 . . . . 0.0 110.975 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -53.83 -43.64 69.59 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.487 0.66 . . . . 0.0 110.552 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 55.89 41.34 30.12 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.404 0.621 . . . . 0.0 111.165 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -156.67 -72.63 0.1 Allowed 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.724 -0.61 . . . . 0.0 112.18 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.773 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -68.19 -37.6 78.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-O 121.508 0.67 . . . . 0.0 111.684 -178.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.18 -33.65 41.59 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.987 -0.446 . . . . 0.0 112.163 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -56.97 -49.52 75.46 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.592 0.711 . . . . 0.0 110.205 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.678 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.22 -40.79 94.59 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.193 0.52 . . . . 0.0 109.788 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' C' ' 675' ' ' ILE . 13.7 mt -66.07 -38.25 87.82 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -96.02 -18.48 20.19 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.42 -16.06 31.77 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.644 -0.66 . . . . 0.0 111.809 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.678 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.3 pt -62.93 -37.02 78.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.785 -0.572 . . . . 0.0 111.439 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -53.79 -47.38 70.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.611 0.719 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.459 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.92 -36.52 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.74 -32.09 70.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.376 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 1.036 HG21 HD12 ' A' ' 686' ' ' ILE . 9.4 mm -61.16 -47.78 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.168 0.509 . . . . 0.0 109.856 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.4 mt -62.48 -39.86 85.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.206 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.5 mt -58.86 -36.83 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.404 HG23 ' O ' ' C' ' 685' ' ' PHE . 75.8 t -53.98 -40.05 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.8 -41.15 90.66 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.2 m -64.44 -37.8 88.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.656 0.741 . . . . 0.0 109.488 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -59.52 -43.54 93.38 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.262 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.422 ' HB ' HG12 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -68.12 -41.9 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 122.114 -0.366 . . . . 0.0 110.975 -177.514 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.72 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -26.65 65.15 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.626 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.5 tt -67.47 -40.33 85.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.882 0.849 . . . . 0.0 110.376 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -55.65 -28.98 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.72 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -59.31 -35.63 59.23 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.501 -0.75 . . . . 0.0 111.416 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.626 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.9 p -54.1 -29.82 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -55.9 -31.32 62.75 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.793 -0.567 . . . . 0.0 110.303 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.45 81.28 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.08 -41.89 81.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.91 -37.34 79.16 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.568 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 73.5 m -62.64 -39.31 93.44 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.989 0.423 . . . . 0.0 110.765 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -40.91 96.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.868 0.842 . . . . 0.0 108.857 178.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.467 HG22 HD21 ' C' ' 748' ' ' LEU . 98.1 t -62.04 -44.69 99.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -62.23 -35.64 79.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.593 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.419 ' HG2' ' CZ ' ' B' ' 707' ' ' ARG . 2.5 tmm_? -60.07 -50.92 71.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.907 0.86 . . . . 0.0 111.078 -177.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.492 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -77.72 -44.3 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.813 0.816 . . . . 0.0 111.167 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -72.97 -34.71 66.65 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.405 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.426 HE22 HD21 ' B' ' 755' ' ' LEU . 8.3 tt0 -102.82 -20.89 14.14 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 115.58 -177.27 17.07 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -128.25 -50.96 1.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.471 ' HA ' HG21 ' B' ' 708' ' ' VAL . 31.6 p -106.78 159.48 29.74 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.356 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -34.06 94.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 122.424 2.082 . . . . 0.0 112.869 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.412 HD23 ' OD2' ' B' ' 758' ' ' ASP . 18.8 tp -81.03 -1.88 45.76 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.958 0.885 . . . . 0.0 113.315 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.797 0.808 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 tpt85 -59.03 -30.5 68.07 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.254 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -56.43 -13.38 2.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.669 ' HE ' HD12 ' B' ' 774' ' ' LEU . 16.8 mtm-85 -75.57 -44.84 41.12 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.565 -0.709 . . . . 0.0 111.468 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.35 -44.36 88.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.188 0.518 . . . . 0.0 109.991 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -36.04 71.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.041 0.448 . . . . 0.0 110.327 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -57.56 -42.86 83.87 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.908 -0.495 . . . . 0.0 110.274 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.546 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.5 mp -53.96 -19.74 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.635 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . 0.711 ' HA ' HD22 ' B' ' 785' ' ' LEU . 65.5 mtt180 -59.44 -34.26 72.29 Favored 'General case' 0 C--N 1.343 0.285 0 O-C-N 121.071 -1.018 . . . . 0.0 109.26 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.545 ' O ' HD23 ' C' ' 748' ' ' LEU . 9.6 tt -57.35 -17.64 13.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . 0.583 HG12 ' ND2' ' C' ' 750' ' ' ASN . 0.3 OUTLIER -55.84 -53.35 38.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -179.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.873 ' ND2' HD23 ' B' ' 785' ' ' LEU . 4.7 m-80 -71.89 -18.68 62.03 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.558 0.694 . . . . 0.0 109.568 175.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.27 -20.58 36.8 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.9 p -58.31 -37.9 75.99 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -69.22 -50.34 48.22 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.653 0.74 . . . . 0.0 109.232 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.09 -34.64 72.22 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.935 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.465 ' C ' HD23 ' C' ' 755' ' ' LEU . 7.0 tt -58.71 -45.47 89.48 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.908 -0.495 . . . . 0.0 111.067 -177.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 74.2 mt -68.26 -41.78 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.771 0.796 . . . . 0.0 108.981 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -67.1 -30.68 70.77 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.74 -45.67 92.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.224 -0.923 . . . . 0.0 108.608 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -42.27 72.69 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.595 0.712 . . . . 0.0 110.975 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -42.64 76.63 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . 0.442 ' O ' HD12 ' C' ' 765' ' ' LEU . 19.9 mtm180 -74.57 -49.44 21.78 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.062 0.458 . . . . 0.0 111.841 -178.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.6 t -59.77 -45.85 91.0 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.478 -0.764 . . . . 0.0 110.18 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.438 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.2 tt -68.84 -54.15 17.34 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.574 ' CB ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -99.19 -49.63 4.42 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.826 0.822 . . . . 0.0 112.785 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . 0.442 HD12 ' O ' ' C' ' 761' ' ' ARG . 0.4 OUTLIER 77.41 -179.53 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.474 0.709 . . . . 0.0 109.368 -177.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.99 138.09 6.84 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.476 0.655 . . . . 0.0 111.156 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 m 57.94 165.07 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.5 0.667 . . . . 0.0 111.065 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.32 0.65 43.38 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.402 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -81.62 -44.76 16.76 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 -64.15 -28.36 69.71 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.561 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.574 HD12 ' CB ' ' C' ' 764' ' ' SER . 0.3 OUTLIER -58.18 -30.1 66.16 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.35 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -56.61 -32.88 65.72 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -65.27 -47.32 77.12 Favored 'General case' 0 C--N 1.352 0.693 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.561 HD13 HD12 ' C' ' 777' ' ' ILE . 4.5 mm? -59.2 -37.6 77.86 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.603 0.716 . . . . 0.0 110.319 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.55 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.3 mp -57.68 -36.35 71.82 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.652 0.739 . . . . 0.0 109.909 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.89 -40.42 60.93 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.507 -0.746 . . . . 0.0 110.361 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.603 HG21 HH11 ' A' ' 742' ' ' ARG . 41.9 mt -62.88 -37.37 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 O-C-N 122.252 -0.28 . . . . 0.0 111.618 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.55 HG22 ' O ' ' C' ' 775' ' ' LEU . 29.6 m -55.44 -39.59 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.281 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.7 m -63.47 -40.67 97.72 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-O 121.971 0.891 . . . . 0.0 109.584 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.81 -38.42 86.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.657 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.797 HG21 ' HB ' ' A' ' 746' ' ' ILE . 63.9 mt -60.56 -42.22 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.8 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.402 ' HA ' ' CG ' ' A' ' 747' ' ' ARG . 48.6 t -53.7 -38.33 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.631 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 . . . . . 0 CA--C 1.54 0.586 0 O-C-N 121.93 -0.481 . . . . 0.0 111.358 178.424 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.717 ' N ' HD23 ' C' ' 663' ' ' LEU . 3.5 tp . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 47.3 mt 58.13 104.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.772 0.796 . . . . 0.0 110.834 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -174.65 -171.51 0.57 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.568 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.2 tt -52.69 -41.22 63.67 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.564 -0.71 . . . . 0.0 110.635 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.5 -32.24 66.02 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -77.48 -44.93 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.435 0.636 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -70.46 -44.64 67.33 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.3 0.571 . . . . 0.0 110.847 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.79 65.82 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.524 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 46.3 t -66.92 -34.94 78.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.208 0.528 . . . . 0.0 111.271 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -35.22 74.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.376 0.608 . . . . 0.0 111.079 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.88 -22.79 62.82 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.203 0.525 . . . . 0.0 111.242 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -79.86 -20.81 45.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.247 0.546 . . . . 0.0 111.264 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -71.55 -49.79 37.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.598 0.713 . . . . 0.0 110.456 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 39.3 t80 62.15 39.38 12.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.832 0.825 . . . . 0.0 111.118 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -152.77 -68.3 0.16 Allowed 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.83 -0.544 . . . . 0.0 110.94 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.07 -36.95 77.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.096 -0.377 . . . . 0.0 111.213 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -51.81 -34.35 39.71 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.84 -50.1 67.99 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 121.685 -0.634 . . . . 0.0 110.32 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.4 t90 -65.69 -44.01 87.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.79 0.805 . . . . 0.0 109.695 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -35.72 81.33 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -96.13 -43.72 7.62 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -68.21 -6.66 24.72 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.693 -0.629 . . . . 0.0 112.552 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.764 HD12 ' N ' ' A' ' 683' ' ' ARG . 1.7 pp -60.63 -36.43 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 121.626 -0.671 . . . . 0.0 110.403 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.764 ' N ' HD12 ' A' ' 682' ' ' ILE . 9.9 ttt-85 -57.06 -47.27 81.38 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.046 0.45 . . . . 0.0 110.606 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -67.74 -34.13 65.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.4 OUTLIER -59.9 -31.33 69.72 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.041 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.872 HG21 HD12 ' B' ' 686' ' ' ILE . 14.5 mm -60.7 -49.31 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.117 0.484 . . . . 0.0 109.824 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.79 -40.39 84.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.99 -36.77 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.86 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 685' ' ' PHE . 86.9 t -54.16 -39.83 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.4 -37.09 91.5 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.4 m -64.87 -38.29 90.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.759 0.79 . . . . 0.0 109.602 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.751 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.1 -40.8 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.339 -179.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.81 -23.41 61.15 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.552 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -61.63 -38.28 87.09 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.03 0.919 . . . . 0.0 109.506 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.5 mmt180 -55.92 -28.0 54.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.286 1.034 . . . . 0.0 112.767 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 mm -58.7 -37.44 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 O-C-N 121.077 -1.014 . . . . 0.0 108.339 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.771 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.5 p -67.72 -30.74 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 121.481 -0.762 . . . . 0.0 109.887 176.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.5 m-85 -55.88 -28.68 57.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 110.442 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.04 71.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.8 m -64.49 -36.0 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.669 -0.644 . . . . 0.0 110.043 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.2 tp -57.7 -40.05 78.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 122.028 -0.42 . . . . 0.0 111.016 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . 0.548 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 1.6 m -62.78 -37.41 86.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.534 0.683 . . . . 0.0 110.499 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -42.0 96.7 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 122.089 0.947 . . . . 0.0 108.702 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 748' ' ' LEU . 73.4 t -65.18 -43.74 95.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.981 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 1.6 m-80 -62.22 -42.89 99.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.356 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.54 HH21 HG23 ' A' ' 708' ' ' VAL . 7.6 tmm_? -60.99 -43.79 98.36 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.411 0.624 . . . . 0.0 110.697 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.54 HG23 HH21 ' A' ' 707' ' ' ARG . 0.9 OUTLIER -74.4 -43.47 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.178 0.989 . . . . 0.0 109.179 178.795 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.13 -15.04 61.49 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.5 OUTLIER -101.23 -22.3 14.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.62 1.554 . . . . 0.0 113.268 -177.552 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . 0.587 ' HA3' HD22 ' A' ' 715' ' ' LEU . . . 130.98 14.07 1.89 Allowed Glycine 0 CA--C 1.537 1.422 0 O-C-N 121.376 -0.828 . . . . 0.0 113.544 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.468 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 61.33 -127.62 0.83 Allowed 'General case' 0 CA--C 1.571 1.775 0 O-C-N 121.556 -0.967 . . . . 0.0 110.466 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.468 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 89.3 p -62.08 159.9 34.41 Favored Pre-proline 0 C--N 1.353 0.72 0 O-C-N 120.669 -1.27 . . . . 0.0 110.782 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -35.12 110.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.301 2.0 . . . . 0.0 112.593 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.639 HD23 ' OD2' ' C' ' 758' ' ' ASP . 0.0 OUTLIER -109.04 -20.73 12.92 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 122.56 1.172 . . . . 0.0 111.798 -179.622 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 121.683 0.754 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -58.02 -26.47 62.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.595 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -9.23 0.42 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 8.1 mtm-85 -62.89 -46.53 87.38 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.369 -0.832 . . . . 0.0 111.142 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.543 ' O ' HG23 ' C' ' 781' ' ' ILE . 44.4 p-10 -65.84 -38.68 89.51 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.283 0.563 . . . . 0.0 111.871 -178.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -71.44 -38.01 71.39 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 121.163 -0.96 . . . . 0.0 109.845 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 20.6 p -66.25 -45.96 78.77 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.948 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.83 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.4 mp -63.12 -46.74 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-O 117.89 -1.053 . . . . 0.0 111.262 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.446 ' HD2' ' HA ' ' C' ' 782' ' ' VAL 0.321 0.1 OUTLIER -69.93 -0.06 6.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 115.822 -2.351 . . . . 0.0 111.614 -177.624 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.795 ' O ' HD13 ' A' ' 748' ' ' LEU . 2.8 tm? -57.23 -15.65 6.41 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 169.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.515 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.314 2.0 t -53.4 -54.64 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 175.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.56 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.3 m-80 -73.25 -27.21 61.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.48 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.478 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.8 -19.3 28.35 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.697 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 52.2 p -57.27 -37.23 72.07 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.91 -49.45 76.15 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.29 72.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.646 178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.15 -43.24 92.04 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.706 -0.621 . . . . 0.0 111.899 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . 0.424 HG22 HD12 ' A' ' 760' ' ' LEU . 49.2 mt -61.36 -33.66 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -69.43 -30.63 68.6 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.947 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 5.7 m-20 -56.07 -48.44 76.07 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.985 0.898 . . . . 0.0 108.955 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.39 -44.3 68.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.509 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.424 HD12 HG22 ' A' ' 756' ' ' ILE . 30.1 mt -67.37 -35.0 78.46 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -177.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 32.4 mtm180 -79.73 -19.51 48.63 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 68.6 p -77.36 -46.39 22.99 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.34 -0.85 . . . . 0.0 111.27 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 mp -68.89 -53.97 18.16 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 53.8 p -98.45 -48.95 4.83 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.221 -0.924 . . . . 0.0 111.939 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.8 tp 89.22 -82.97 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.675 1.19 . . . . 0.0 110.263 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -106.05 -65.42 1.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.572 -0.705 . . . . 0.0 110.756 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.6 m -103.05 144.44 31.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.117 0.484 . . . . 0.0 110.596 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -62.41 -26.74 68.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.085 0.469 . . . . 0.0 110.373 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -52.98 -39.06 62.73 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.599 0.714 . . . . 0.0 109.885 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.4 tpt85 -63.35 -30.62 71.72 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.662 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.42 -38.24 83.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.165 0.507 . . . . 0.0 110.481 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 58.0 ttp180 -59.03 -42.16 89.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.648 0.737 . . . . 0.0 109.207 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -69.05 -43.42 74.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.821 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -62.16 -37.7 86.19 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 121.53 0.681 . . . . 0.0 111.46 -179.317 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.39 -36.92 83.83 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 121.65 -0.656 . . . . 0.0 111.062 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.4 mt -74.15 -44.43 53.63 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 774' ' ' LEU . 2.3 pp -59.96 -37.14 71.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 121.98 -0.45 . . . . 0.0 111.419 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.753 ' O ' HG22 ' A' ' 781' ' ' ILE . 26.7 m -65.92 -43.17 93.0 Favored 'Isoleucine or valine' 0 C--N 1.346 0.42 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.757 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 782' ' ' VAL . 47.2 p -63.81 -46.6 84.39 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.433 -0.792 . . . . 0.0 111.508 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.11 -30.32 71.5 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.774 HG21 ' CG2' ' B' ' 746' ' ' ILE . 0.2 OUTLIER -53.35 -35.24 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 O-C-N 121.847 -0.533 . . . . 0.0 110.563 -178.01 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 779' ' ' THR . 17.1 m -53.76 -38.33 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -62.69 -43.22 99.37 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.761 0.791 . . . . 0.0 110.216 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 22.5 tp -68.03 -40.98 82.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.359 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 120.988 0.423 . . . . 0.0 111.826 -179.246 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 61.91 112.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.227 0.536 . . . . 0.0 109.865 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 170.99 -176.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.669 HD13 HD22 ' C' ' 660' ' ' LEU . 5.7 tp -54.33 -48.42 71.39 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 122.171 0.986 . . . . 0.0 109.663 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -65.4 -32.44 74.07 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.541 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -78.73 -44.18 24.07 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.151 0.5 . . . . 0.0 110.726 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.73 -44.08 62.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.299 0.571 . . . . 0.0 111.319 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.57 -30.28 71.2 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.999 0.428 . . . . 0.0 111.534 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 24.5 p -63.35 -25.79 68.46 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.068 0.461 . . . . 0.0 111.699 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.05 -38.67 86.99 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.304 0.574 . . . . 0.0 110.963 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -61.71 -12.98 19.05 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.978 0.418 . . . . 0.0 111.537 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.64 -32.28 20.65 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.241 0.543 . . . . 0.0 111.252 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.57 -52.19 64.4 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.48 0.657 . . . . 0.0 110.507 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 33.1 t80 58.19 27.76 15.56 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.409 0.623 . . . . 0.0 112.184 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -141.07 -71.17 0.36 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.436 0.636 . . . . 0.0 110.455 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.69 HD11 HD23 ' B' ' 679' ' ' LEU . 0.1 OUTLIER -68.18 -36.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.4 m -51.28 -33.49 28.86 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.039 -0.413 . . . . 0.0 111.539 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.94 -50.31 73.01 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.704 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.4 t90 -66.16 -41.86 89.77 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.933 0.873 . . . . 0.0 109.422 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.69 HD23 HD11 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -58.07 -35.52 71.49 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -177.723 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -109.46 -31.19 7.61 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -68.22 -6.76 25.34 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.451 -0.781 . . . . 0.0 112.91 -177.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.704 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.41 -36.29 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.6 -0.688 . . . . 0.0 110.839 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -53.32 -47.6 69.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.615 0.245 . . . . 0.0 111.028 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -71.54 -35.64 57.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.7 -31.07 69.25 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.064 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.872 HD12 HG21 ' A' ' 686' ' ' ILE . 15.0 mm -60.89 -47.28 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.774 -0.579 . . . . 0.0 109.918 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.71 -41.67 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.72 -37.94 73.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -60.18 -40.15 82.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . 0.545 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -61.41 -27.1 67.24 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 19.9 m -60.78 -45.38 94.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.607 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -33.13 71.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -176.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.859 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.1 OUTLIER -57.86 -43.93 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.932 0.787 . . . . 0.0 109.739 -178.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.05 -32.68 83.11 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.55 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.8 tt -60.46 -37.48 81.12 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 122.067 0.937 . . . . 0.0 110.769 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.751 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.9 mmt180 -55.87 -28.49 56.8 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.754 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.59 -36.39 59.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 O-C-N 120.978 -1.076 . . . . 0.0 110.419 -176.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -56.82 -30.22 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 121.253 -0.905 . . . . 0.0 110.561 178.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -56.53 -30.92 63.61 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.711 -0.618 . . . . 0.0 110.317 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.69 77.75 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -41.82 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.48 -37.74 73.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.077 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.7 m -62.86 -35.46 80.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 110.537 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.77 -43.21 97.07 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 122.406 1.098 . . . . 0.0 108.997 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.521 HG13 HD11 ' B' ' 748' ' ' LEU . 94.7 t -69.39 -45.49 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.201 1.001 . . . . 0.0 109.354 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.475 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.5 m-80 -62.82 -35.58 80.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.199 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 16.1 ttm-85 -66.41 -50.25 64.06 Favored 'General case' 0 N--CA 1.44 -0.934 0 O-C-N 121.301 -0.874 . . . . 0.0 110.688 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.9 OUTLIER -78.72 -45.07 25.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -179.143 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -61.38 -45.23 95.24 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.4 pt20 -104.54 -22.89 13.2 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.66 167.64 11.03 Favored Glycine 0 CA--C 1.534 1.231 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.82 -83.6 0.55 Allowed 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.795 -0.827 . . . . 0.0 112.65 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.8 m -62.87 159.44 45.47 Favored Pre-proline 0 N--CA 1.463 0.184 0 O-C-N 121.331 -0.855 . . . . 0.0 110.177 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.582 ' HG3' HD23 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -30.08 108.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.529 2.153 . . . . 0.0 113.372 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.44 ' O ' ' C ' ' B' ' 716' ' ' SER . 4.8 tt -70.92 -20.38 62.49 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.44 ' C ' ' O ' ' B' ' 715' ' ' LEU . 12.4 t . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 122.402 1.096 . . . . 0.0 112.91 -178.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 11.9 mp0 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 mtp85 -72.24 -28.51 63.2 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.202 0.525 . . . . 0.0 110.975 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.9 -5.19 1.92 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.494 ' NE ' HD11 ' A' ' 774' ' ' LEU . 0.1 OUTLIER -54.87 -32.71 61.1 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.701 -1.249 . . . . 0.0 109.423 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -58.59 -34.61 71.29 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 122.08 0.943 . . . . 0.0 108.553 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . 0.48 ' HG2' HH21 ' B' ' 744' ' ' ARG . 0.0 OUTLIER -63.54 -46.96 83.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 122.141 0.972 . . . . 0.0 109.135 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 13.8 t -62.34 -47.18 85.37 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.783 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.774 ' CG2' HG21 ' A' ' 781' ' ' ILE . 1.4 mp -52.63 -21.4 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 O-C-N 121.24 -0.912 . . . . 0.0 109.655 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -43.54 98.64 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.669 -0.645 . . . . 0.0 110.542 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.521 HD11 HG13 ' B' ' 705' ' ' VAL . 0.9 OUTLIER -55.59 -15.37 2.84 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.668 -0.645 . . . . 0.0 111.964 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.44 -53.76 32.57 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.433 ' H ' HD22 ' B' ' 750' ' ' ASN . 4.0 m-80 -72.59 -17.77 61.66 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.125 174.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.0 -20.06 32.74 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.857 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 3.5 m -58.47 -38.45 77.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 118.356 1.078 . . . . 0.0 109.572 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.33 -48.04 58.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.65 0.738 . . . . 0.0 109.731 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.56 81.38 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -45.24 92.87 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.649 -0.657 . . . . 0.0 110.627 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . 0.439 HG22 HD12 ' B' ' 760' ' ' LEU . 47.2 mt -62.01 -36.4 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.11 -30.96 69.34 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.952 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.512 ' OD2' HD23 ' C' ' 715' ' ' LEU . 6.9 m-20 -55.94 -48.32 75.96 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.56 -45.32 65.67 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.034 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . 0.439 HD12 HG22 ' B' ' 756' ' ' ILE . 19.9 mt -66.91 -31.79 72.61 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -79.98 -49.47 11.79 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.2 m -65.24 -45.23 85.48 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.543 -0.723 . . . . 0.0 111.576 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.586 ' HG ' HD22 ' B' ' 774' ' ' LEU . 1.9 tp -64.66 -53.25 50.48 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.838 -0.539 . . . . 0.0 112.447 -178.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . 0.411 ' OG ' HD12 ' B' ' 771' ' ' LEU . 3.0 m -97.5 -47.57 5.61 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 1.8 mt 71.63 107.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.8 0.81 . . . . 0.0 110.315 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.89 -78.45 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.881 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -110.11 175.47 5.42 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.612 0.72 . . . . 0.0 111.572 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -84.22 -27.96 27.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.064 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.61 -40.14 82.43 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 122.109 0.957 . . . . 0.0 109.149 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.62 -29.26 67.88 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.892 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.411 HD12 ' OG ' ' B' ' 764' ' ' SER . 8.4 tt -59.16 -32.33 69.79 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.679 -0.638 . . . . 0.0 109.986 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -56.78 -32.51 65.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.03 -41.26 99.47 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.586 HD22 ' HG ' ' B' ' 763' ' ' LEU . 2.7 tp -58.86 -38.49 78.9 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-O 121.388 0.613 . . . . 0.0 110.835 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.34 -37.04 74.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.275 0.56 . . . . 0.0 109.997 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.42 -34.85 68.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.056 0.455 . . . . 0.0 110.592 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.3 -39.26 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.089 0.471 . . . . 0.0 109.779 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.76 ' O ' HG22 ' B' ' 781' ' ' ILE . 58.6 t -66.28 -46.63 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.784 -0.572 . . . . 0.0 109.945 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.645 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -64.21 -44.48 91.82 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 122.079 -0.388 . . . . 0.0 112.023 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -31.5 72.04 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 122.052 -0.405 . . . . 0.0 111.739 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.76 HG22 ' O ' ' B' ' 778' ' ' VAL . 0.4 OUTLIER -60.01 -36.6 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 O-C-N 121.727 -0.608 . . . . 0.0 112.07 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.645 HG22 ' O ' ' B' ' 779' ' ' THR . 5.4 m -59.22 -41.78 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 121.655 -0.653 . . . . 0.0 112.083 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -41.85 91.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.273 0.559 . . . . 0.0 111.338 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.68 -44.04 67.84 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.659 HD23 ' CG ' ' C' ' 750' ' ' ASN . 18.9 tp -83.78 -22.87 31.72 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.027 0.441 . . . . 0.0 111.73 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.67 -33.21 62.49 Favored Glycine 0 CA--C 1.533 1.217 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -83.19 146.99 28.3 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.398 0.618 . . . . 0.0 110.581 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.476 179.691 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.669 HD22 HD13 ' B' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 CA-C-O 120.641 0.258 . . . . 0.0 110.784 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 25.7 mt 59.62 110.74 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.519 0.676 . . . . 0.0 110.852 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.6 171.1 10.55 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 121.244 0.545 . . . . 0.0 109.711 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.6 OUTLIER -56.91 -50.48 72.41 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.62 0.724 . . . . 0.0 110.054 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.541 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -75.18 -16.86 60.48 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.908 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -80.96 -49.01 11.5 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.022 0.439 . . . . 0.0 110.881 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -62.71 -46.14 89.52 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.248 0.547 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.23 -23.54 67.47 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -30.55 68.24 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 122.003 -0.436 . . . . 0.0 111.781 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -39.67 94.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -59.47 -13.51 9.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.762 -0.586 . . . . 0.0 111.848 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -81.77 -21.11 37.99 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.277 0.561 . . . . 0.0 110.899 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -62.44 -42.22 99.3 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.648 0.737 . . . . 0.0 110.138 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 61.37 24.76 14.82 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -154.09 -72.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.562 -0.711 . . . . 0.0 112.313 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -37.1 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-O 121.52 0.676 . . . . 0.0 110.257 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.8 m -52.2 -33.7 42.16 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.778 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -56.52 -48.88 76.31 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 121.63 0.729 . . . . 0.0 109.341 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.524 ' O ' HG23 ' C' ' 682' ' ' ILE . 3.8 t90 -58.86 -38.09 77.97 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.874 -0.516 . . . . 0.0 109.8 178.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 9.4 mt -60.72 -41.08 94.6 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -103.27 -39.22 6.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -68.87 -18.56 64.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.759 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.45 -36.57 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.449 -0.782 . . . . 0.0 109.947 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.759 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -53.7 -46.98 70.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.02 -35.23 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.97 -36.77 77.83 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.994 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.811 HG21 HD12 ' A' ' 686' ' ' ILE . 18.5 mm -60.78 -45.53 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.89 -38.43 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.91 -37.99 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.5 -40.01 72.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.29 -37.54 73.87 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.0 m -67.37 -38.64 85.08 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.452 1.12 . . . . 0.0 109.661 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.415 HD23 HG12 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.6 -46.12 89.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.406 -177.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.415 HD12 ' N ' ' C' ' 694' ' ' GLY . 1.7 pp -60.29 -43.63 93.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 O-C-N 122.017 -0.427 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.54 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.74 -30.68 73.17 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.61 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -53.77 -37.22 63.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.058 0.932 . . . . 0.0 110.139 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.859 ' HE ' HD11 ' B' ' 693' ' ' ILE . 23.0 mmt180 -55.69 -27.85 52.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.54 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -57.66 -35.41 50.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.079 -1.013 . . . . 0.0 110.831 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.61 HG12 ' O ' ' C' ' 695' ' ' LEU . 14.5 p -54.08 -29.86 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.223 -0.923 . . . . 0.0 109.527 177.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -56.83 -31.69 65.0 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.263 -0.898 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . 0.548 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.14 -45.3 93.51 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 45.3 t -65.82 -35.86 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.009 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -64.95 -44.89 87.95 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.231 0.539 . . . . 0.0 110.865 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 36.3 p -64.13 -33.04 74.88 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.15 0.5 . . . . 0.0 110.776 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.75 95.23 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.833 0.825 . . . . 0.0 108.922 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' C' ' 748' ' ' LEU . 0.9 OUTLIER -67.62 -45.81 84.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-O 122.149 0.976 . . . . 0.0 108.618 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.06 -36.48 83.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.224 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -49.21 73.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.208 0.528 . . . . 0.0 111.26 -177.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.556 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -76.73 -42.98 34.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.501 0.667 . . . . 0.0 111.511 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -70.38 -41.35 73.18 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.407 ' O ' HD22 ' C' ' 715' ' ' LEU . 3.0 mt-30 -102.23 -22.13 14.23 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.759 0.79 . . . . 0.0 112.973 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.35 160.37 24.21 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -112.98 -47.63 3.03 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.936 -0.743 . . . . 0.0 111.536 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.452 ' HA ' HG21 ' B' ' 708' ' ' VAL . 79.5 p -69.11 144.28 95.14 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 118.616 -0.707 . . . . 0.0 110.306 -179.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -35.23 97.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.553 0 C-N-CA 122.261 1.974 . . . . 0.0 112.394 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.512 HD23 ' OD2' ' B' ' 758' ' ' ASP . 13.6 tp -75.19 5.1 5.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.82 0.819 . . . . 0.0 112.277 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 122.422 1.106 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -61.1 -26.55 67.74 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.61 -1.177 . . . . 0.0 112.084 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.7 -11.59 1.0 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -68.42 -40.89 81.03 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.53 -0.731 . . . . 0.0 111.46 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.33 -36.02 72.78 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 122.031 -0.418 . . . . 0.0 110.501 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -71.34 -46.73 59.84 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.337 0.589 . . . . 0.0 110.017 178.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 3.1 p -59.93 -38.51 82.62 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.469 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.548 ' CG2' HG21 ' B' ' 781' ' ' ILE . 1.0 OUTLIER -57.44 -19.67 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -59.55 -28.11 66.81 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.556 HD11 HG12 ' C' ' 708' ' ' VAL . 15.7 mt -55.65 -20.39 13.8 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.915 178.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . 0.496 HG23 ' O ' ' C' ' 746' ' ' ILE . 70.7 t -56.0 -54.89 21.82 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.659 ' CG ' HD23 ' B' ' 785' ' ' LEU . 3.1 m-80 -73.29 -21.9 60.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.784 174.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.15 33.32 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.206 -178.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 37.5 m -58.59 -37.73 76.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 117.921 0.861 . . . . 0.0 109.315 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -69.45 -50.44 45.55 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.496 0.665 . . . . 0.0 109.743 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.2 -35.36 80.06 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.521 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.7 tm? -59.82 -45.34 92.67 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 111.158 -178.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 64.4 mt -67.77 -41.77 85.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.86 0.838 . . . . 0.0 109.338 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.14 -30.09 68.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.207 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . 0.639 ' OD2' HD23 ' A' ' 715' ' ' LEU . 81.4 m-20 -55.32 -48.87 73.5 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.495 -0.753 . . . . 0.0 109.987 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -70.58 -44.72 66.76 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.876 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 62.3 mt -68.88 -36.08 77.66 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 26.2 mtm180 -72.39 -50.02 29.63 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.965 -0.459 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.5 t -64.87 -44.45 89.65 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 122.159 0.981 . . . . 0.0 110.337 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.1 tt -67.94 -53.17 28.36 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.212 -0.903 . . . . 0.0 113.225 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.437 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.3 m -96.78 -37.47 10.26 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 56.5 mt 62.06 116.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.466 0.651 . . . . 0.0 110.128 -178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 2.0 t80 59.29 -162.96 0.23 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.874 -0.516 . . . . 0.0 109.997 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 p -83.38 91.89 7.43 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.667 0.746 . . . . 0.0 111.671 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 42.42 -165.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.888 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 10.9 t60 75.91 -61.42 0.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -61.31 -30.06 70.26 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.702 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.437 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.0 tt -60.04 -30.8 69.43 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 122.075 -0.391 . . . . 0.0 109.957 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -56.69 -35.15 68.15 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . 0.401 ' O ' HG13 ' C' ' 777' ' ' ILE . 3.7 m-20 -67.12 -37.06 83.23 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.684 HD13 ' O ' ' C' ' 774' ' ' LEU . 1.8 tm? -58.06 -38.49 76.41 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.064 0.459 . . . . 0.0 110.21 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.467 ' O ' HG22 ' C' ' 778' ' ' VAL . 9.8 mp -58.98 -37.59 77.16 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 51.1 mt -75.09 -39.99 60.33 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 121.675 -0.641 . . . . 0.0 111.339 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.474 HG22 HG13 ' C' ' 781' ' ' ILE . 29.1 mt -62.49 -37.49 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.563 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.467 HG22 ' O ' ' C' ' 775' ' ' LEU . 7.8 m -55.16 -39.83 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.202 0.91 . . . . 0.0 110.015 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.445 ' O ' HG22 ' C' ' 782' ' ' VAL . 5.8 m -63.41 -39.8 95.47 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 121.871 0.843 . . . . 0.0 109.741 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.43 -37.55 83.2 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.536 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.83 HG21 ' HB ' ' A' ' 746' ' ' ILE . 89.4 mt -61.69 -47.69 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.41 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.446 ' HA ' ' HD2' ' A' ' 747' ' ' ARG . 20.7 m -54.13 -37.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 119.23 -0.988 . . . . 0.0 110.677 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 CA--C 1.543 0.696 0 CA-C-O 121.318 0.58 . . . . 0.0 111.694 179.199 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 121.669 0.747 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mt 61.92 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.996 0.903 . . . . 0.0 111.82 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 174.81 163.59 0.23 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.495 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.416 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.8 OUTLIER -46.36 -41.48 13.52 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.64 0.733 . . . . 0.0 110.148 178.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -33.87 76.97 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.774 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -74.8 -44.77 47.7 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.417 0.627 . . . . 0.0 109.782 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -63.12 -46.39 87.53 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.436 0.636 . . . . 0.0 110.364 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.19 61.82 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.493 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 2.7 m -65.38 -33.25 75.52 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.604 HD23 HG23 ' A' ' 676' ' ' THR . 19.6 tp -65.35 -23.75 67.07 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.808 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -60.02 -29.47 68.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.933 -0.48 . . . . 0.0 111.586 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.8 -14.48 62.78 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 19.4 m95 -68.44 -49.63 58.5 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.439 0.638 . . . . 0.0 110.108 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 13.3 t80 65.83 2.77 2.28 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -126.04 -66.78 0.91 Allowed 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.279 -0.888 . . . . 0.0 111.942 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.42 -36.92 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 121.368 0.604 . . . . 0.0 111.025 -179.049 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.604 HG23 HD23 ' A' ' 669' ' ' LEU . 2.9 m -52.07 -33.38 38.96 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.471 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -56.4 -49.57 74.1 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.507 0.67 . . . . 0.0 109.777 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.77 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.8 t90 -65.36 -43.9 89.34 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 121.084 0.469 . . . . 0.0 109.809 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.485 HD12 HD21 ' A' ' 669' ' ' LEU . 2.6 mt -61.92 -34.85 76.83 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.9 t90 -103.52 -15.03 15.97 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -94.5 -9.19 36.15 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.77 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -62.38 -35.95 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 O-C-N 121.371 -0.831 . . . . 0.0 110.818 179.054 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -47.42 68.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.783 0.325 . . . . 0.0 111.266 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -70.9 -35.34 59.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.496 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -60.61 -29.0 68.94 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.584 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.868 HD12 HG21 ' C' ' 686' ' ' ILE . 15.9 mm -60.52 -51.06 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.739 -0.601 . . . . 0.0 110.123 -179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.62 -41.03 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.93 -37.49 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.31 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 685' ' ' PHE . 61.6 t -54.86 -43.29 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -52.68 -40.08 55.44 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.9 m -65.49 -38.67 90.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.848 0.832 . . . . 0.0 109.615 177.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.73 -43.05 94.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.304 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.512 HD11 HH11 ' B' ' 696' ' ' ARG . 0.8 OUTLIER -65.36 -42.7 94.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-O 121.126 0.489 . . . . 0.0 109.951 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.85 -24.92 65.17 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 178.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -55.92 -38.61 70.51 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.021 0.915 . . . . 0.0 109.185 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.0 mmt180 -55.72 -28.15 54.26 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.827 0.851 . . . . 0.0 111.775 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.99 -39.09 77.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.801 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.74 -30.76 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.662 -0.649 . . . . 0.0 109.963 176.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.9 m-85 -55.76 -29.34 59.45 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 122.003 -0.436 . . . . 0.0 110.692 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.56 -37.24 72.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -60.71 -35.98 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 O-C-N 121.701 -0.624 . . . . 0.0 109.503 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.92 -44.62 91.35 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.81 -0.556 . . . . 0.0 109.88 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -34.66 77.78 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 122.117 0.96 . . . . 0.0 108.819 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.573 HD13 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -60.63 -44.29 96.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 122.308 1.052 . . . . 0.0 108.272 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.669 HG22 HD12 ' A' ' 748' ' ' LEU . 54.2 t -66.81 -41.81 88.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.889 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -62.34 -36.91 83.68 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.036 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.573 HH22 HD13 ' A' ' 704' ' ' LEU . 36.0 ttm105 -57.65 -49.49 76.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 120.833 -1.167 . . . . 0.0 110.481 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.412 HG21 ' HD2' ' B' ' 714' ' ' PRO . 1.0 OUTLIER -76.97 -45.21 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.147 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -74.71 -18.33 60.53 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.4 HE22 HD21 ' C' ' 755' ' ' LEU . 4.5 tt0 -101.26 -21.01 15.01 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -175.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 120.15 13.64 5.83 Favored Glycine 0 CA--C 1.542 1.78 0 O-C-N 121.604 -0.685 . . . . 0.0 113.115 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 59.29 -83.77 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 O-C-N 121.934 -0.745 . . . . 0.0 112.069 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 92.2 p -102.77 159.99 27.62 Favored Pre-proline 0 C--N 1.347 0.462 0 O-C-N 121.2 -0.938 . . . . 0.0 109.721 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -41.75 106.57 0.07 OUTLIER 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.386 1.391 . . . . 0.0 111.104 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.555 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -104.82 -20.64 13.53 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -175.733 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.555 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.1 t . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 121.498 0.666 . . . . 0.0 111.723 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 . . . . . 0 C--O 1.237 0.395 0 CA-C-O 121.714 0.768 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -57.91 -26.29 62.0 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.305 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -15.65 2.87 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.915 -0.49 . . . . 0.0 111.394 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.595 ' CZ ' HD21 ' C' ' 774' ' ' LEU . 21.0 ttp180 -62.61 -46.12 89.73 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.858 -0.526 . . . . 0.0 109.898 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -59.15 -33.89 71.44 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.849 0.833 . . . . 0.0 109.043 178.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.54 66.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.721 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 8.4 p -58.44 -44.46 89.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.835 -0.541 . . . . 0.0 110.204 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.792 ' O ' HG22 ' A' ' 749' ' ' VAL . 1.9 mp -56.52 -20.9 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.245 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 -59.14 -24.29 62.9 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.468 -0.77 . . . . 0.0 110.178 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.786 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -70.59 -17.87 62.9 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.984 -0.448 . . . . 0.0 111.576 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.792 HG22 ' O ' ' A' ' 746' ' ' ILE . 29.9 m -55.76 -54.91 21.06 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 O-C-N 120.793 -1.192 . . . . 0.0 110.78 -178.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.671 ' ND2' HG23 ' A' ' 749' ' ' VAL . 1.2 m-80 -72.75 -21.42 61.02 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 173.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.68 30.82 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.699 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 3.3 p -57.92 -37.79 74.73 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.808 0.804 . . . . 0.0 109.261 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.9 tp -65.38 -49.48 69.15 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.98 -34.58 76.41 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.703 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.415 ' C ' HD23 ' A' ' 755' ' ' LEU . 7.0 tt -58.77 -44.85 90.74 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 122.013 -0.43 . . . . 0.0 111.477 -177.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 6.7 mm -63.04 -33.33 60.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.29 -30.02 68.01 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.494 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 30.5 m-20 -54.97 -47.13 74.97 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.672 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.58 -45.2 65.83 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.733 0.778 . . . . 0.0 111.043 178.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.458 ' HA ' HD11 ' A' ' 763' ' ' LEU . 24.2 mt -62.54 -29.58 70.67 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 44.7 mtt85 -81.07 -23.28 38.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 9.9 t -75.75 -46.83 28.71 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.88 -1.137 . . . . 0.0 111.955 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.531 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.0 OUTLIER -69.66 -54.37 14.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . 0.4 ' O ' ' HB3' ' A' ' 765' ' ' LEU . 18.4 p -98.09 -36.97 9.92 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -176.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.555 HD22 ' O ' ' A' ' 765' ' ' LEU . 0.6 OUTLIER 73.35 -61.62 0.49 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.142 0.577 . . . . 0.0 110.745 -177.607 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . 0.536 ' HB2' HD13 ' A' ' 765' ' ' LEU . 40.7 t80 -139.13 -68.74 0.43 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.602 -0.686 . . . . 0.0 111.048 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.9 m -79.78 126.3 30.79 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.982 -0.449 . . . . 0.0 110.02 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.514 ' CE1' HD13 ' A' ' 771' ' ' LEU . 2.7 t80 -57.3 -20.42 28.16 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.967 0.413 . . . . 0.0 110.926 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.1 -40.19 95.02 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.982 0.896 . . . . 0.0 108.745 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -55.86 -29.22 59.54 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.268 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.514 HD13 ' CE1' ' A' ' 768' ' ' TYR . 8.6 tt -59.3 -38.47 80.31 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.957 -0.464 . . . . 0.0 111.608 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -64.63 -32.83 74.67 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.333 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.75 -42.42 99.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.091 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 763' ' ' LEU . 4.0 tp -58.45 -42.19 86.83 Favored 'General case' 0 C--N 1.354 0.776 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.346 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.4 tp -59.06 -36.86 75.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.017 0.437 . . . . 0.0 112.163 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 26.5 mt -74.57 -44.39 51.12 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.953 -0.467 . . . . 0.0 111.529 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 34.3 pt -68.4 -37.19 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 O-C-N 122.119 -0.363 . . . . 0.0 111.312 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.74 -46.6 96.19 Favored 'Isoleucine or valine' 0 C--N 1.345 0.387 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.166 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 782' ' ' VAL . 36.7 p -64.66 -36.71 85.14 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.872 0.844 . . . . 0.0 110.813 177.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -43.87 77.24 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.71 HD11 ' CG2' ' B' ' 746' ' ' ILE . 35.3 pt -69.97 -36.73 70.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 779' ' ' THR . 21.3 m -55.76 -38.05 49.54 Favored 'Isoleucine or valine' 0 C--N 1.359 1.019 0 CA-C-N 119.427 1.012 . . . . 0.0 109.117 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.08 -50.36 69.35 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 121.826 0.822 . . . . 0.0 110.112 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.5 -41.03 98.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 CA--C 1.538 0.503 0 CA-C-O 121.339 0.59 . . . . 0.0 111.188 179.996 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.666 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.666 HD22 ' C ' ' B' ' 660' ' ' LEU . 0.4 OUTLIER 60.2 124.12 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.173 0.511 . . . . 0.0 110.598 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' B' ' 663' ' ' LEU . 0.4 OUTLIER -174.64 29.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.604 -0.685 . . . . 0.0 112.025 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.592 HD12 HD13 ' C' ' 660' ' ' LEU . 0.3 OUTLIER 75.06 -42.74 0.49 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.799 0.809 . . . . 0.0 109.657 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.539 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.7 t70 -79.98 -31.87 39.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.762 0.792 . . . . 0.0 109.874 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.53 -41.54 79.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.507 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.592 ' CE2' HD12 ' B' ' 661' ' ' LEU . 89.1 m95 -75.02 -46.51 34.54 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.338 0.589 . . . . 0.0 111.534 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.29 71.19 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.87 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 88.3 p -62.76 -33.48 75.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.977 0.417 . . . . 0.0 111.474 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.82 -32.02 70.26 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.297 0.57 . . . . 0.0 111.081 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -62.55 -23.26 66.89 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.899 0.381 . . . . 0.0 111.918 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -81.79 -13.06 58.22 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.897 0.38 . . . . 0.0 111.813 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -69.98 -46.69 64.66 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.48 0.657 . . . . 0.0 110.903 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 47.8 t80 57.26 34.39 24.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.73 0.776 . . . . 0.0 110.939 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -140.7 -87.53 0.18 Allowed 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.781 -0.574 . . . . 0.0 111.139 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.408 HG12 ' CE3' ' B' ' 678' ' ' TRP . 18.5 tt -68.2 -35.98 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 O-C-N 121.57 -0.706 . . . . 0.0 112.178 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.2 m -50.38 -32.5 17.68 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.714 -0.616 . . . . 0.0 111.545 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -55.96 -44.86 78.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.625 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -60.61 -43.7 97.14 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.838 0.828 . . . . 0.0 108.905 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.1 tp -57.86 -40.11 79.38 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.815 -178.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -100.85 -3.05 30.55 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -101.47 -23.14 14.38 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.589 -0.694 . . . . 0.0 112.164 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.625 HG23 ' O ' ' B' ' 678' ' ' TRP . 28.8 pt -60.44 -35.83 65.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 O-C-N 121.875 -0.516 . . . . 0.0 110.494 178.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 22.3 ttt-85 -53.31 -47.2 69.46 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.792 -0.568 . . . . 0.0 110.098 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.485 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.1 mp -75.21 -36.3 36.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.66 -27.66 66.58 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.874 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.47 -45.36 97.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.32 -43.57 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 97.0 mt -58.64 -37.74 67.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' B' ' 685' ' ' PHE . 45.5 t -61.69 -47.46 93.24 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.936 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.15 -27.06 13.8 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.774 -0.579 . . . . 0.0 112.205 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 37.0 m -60.63 -44.16 96.68 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.574 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.46 -32.39 70.19 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.154 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.574 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.5 OUTLIER -57.71 -44.58 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.301 -0.875 . . . . 0.0 108.694 -178.731 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.46 -31.55 77.88 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 178.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.615 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.18 -37.82 67.55 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 122.065 0.936 . . . . 0.0 109.467 178.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.512 HH11 HD11 ' A' ' 693' ' ' ILE . 24.0 mmt180 -55.65 -28.55 56.04 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.638 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.02 -35.95 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 121.022 -1.048 . . . . 0.0 108.943 -178.987 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.615 HG12 ' O ' ' B' ' 695' ' ' LEU . 1.2 p -66.04 -30.2 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 O-C-N 121.901 -0.5 . . . . 0.0 110.269 177.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 3.4 m-85 -56.12 -30.71 62.49 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.828 -0.545 . . . . 0.0 109.532 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.81 77.29 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 177.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.38 -38.14 76.74 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.451 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 9.2 tp -58.72 -43.67 90.2 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.069 -0.395 . . . . 0.0 110.281 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 80.3 p -63.82 -31.72 73.0 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.778 0.799 . . . . 0.0 109.839 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -47.29 83.99 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 122.531 1.157 . . . . 0.0 109.142 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.465 ' HA ' HD13 ' B' ' 748' ' ' LEU . 56.1 t -70.19 -45.18 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.631 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.82 -36.04 81.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.143 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.442 HH21 ' HG3' ' B' ' 707' ' ' ARG . 4.6 ttm-85 -63.11 -49.28 75.04 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.524 1.154 . . . . 0.0 109.772 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.453 HG21 ' HD3' ' C' ' 714' ' ' PRO . 2.2 t -77.28 -44.82 30.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 114.27 -1.332 . . . . 0.0 114.183 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -70.22 -45.02 67.39 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -175.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.9 pt20 -104.97 -22.96 13.04 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 127.94 177.43 14.86 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . 0.48 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.0 p90 -129.97 -69.45 0.67 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 21.8 m -62.24 159.36 40.03 Favored Pre-proline 0 N--CA 1.467 0.391 0 O-C-N 121.312 -0.867 . . . . 0.0 109.24 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.412 ' HD2' HG21 ' A' ' 708' ' ' VAL . 37.8 Cg_exo -34.26 102.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.16 1.907 . . . . 0.0 111.884 -178.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.458 ' O ' ' C ' ' B' ' 716' ' ' SER . 0.5 OUTLIER -76.28 -20.0 57.75 Favored 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -175.393 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.458 ' C ' ' O ' ' B' ' 715' ' ' LEU . 77.6 p . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.524 0.678 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.16 -26.51 62.11 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -178.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -13.13 57.68 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.07 71.21 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 121.034 -1.041 . . . . 0.0 112.124 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.44 -45.27 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.28 -37.07 71.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.178 0.513 . . . . 0.0 110.208 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . 0.407 ' HB3' HG12 ' B' ' 708' ' ' VAL . 52.8 m -57.13 -34.09 68.04 Favored 'General case' 0 C--O 1.231 0.084 0 CA-C-O 120.992 0.425 . . . . 0.0 110.49 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.71 ' CG2' HD11 ' A' ' 781' ' ' ILE . 23.1 mt -57.68 -16.08 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.66 -33.51 71.64 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 177.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' B' ' 705' ' ' VAL . 0.4 OUTLIER -55.73 -16.16 3.97 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.668 178.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 39.6 t -55.77 -53.69 34.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 177.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.1 -19.93 61.72 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.084 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.87 31.53 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.834 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.22 -37.64 75.23 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.956 -0.732 . . . . 0.0 109.379 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.0 -48.58 57.58 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 108.945 177.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.71 -34.84 73.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.805 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.03 -42.93 91.4 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.992 0.425 . . . . 0.0 111.233 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 46.6 mm -67.77 -35.62 73.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.51 -33.53 74.3 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.449 ' OD2' HD23 ' C' ' 715' ' ' LEU . 10.0 m-20 -55.92 -47.99 76.49 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.208 -0.933 . . . . 0.0 108.889 179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.45 -45.13 66.41 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.088 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -46.07 90.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -81.87 -25.4 35.09 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.9 p -71.23 -46.45 61.07 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.944 -1.098 . . . . 0.0 111.648 -177.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.684 ' O ' HD22 ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.45 -54.59 13.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -179.732 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.85 -33.94 10.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 68.52 88.42 0.11 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.743 0.782 . . . . 0.0 109.95 -176.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 58.98 -86.16 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.036 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -79.85 162.23 25.17 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 121.405 -0.809 . . . . 0.0 110.684 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -92.62 25.29 3.13 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.218 0.533 . . . . 0.0 111.479 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -90.98 -41.89 10.85 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.833 0.825 . . . . 0.0 109.149 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -29.46 70.34 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.32 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.37 -34.12 72.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -60.84 -43.18 98.63 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -69.56 -38.4 77.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.714 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.3 OUTLIER -67.34 -38.03 84.22 Favored 'General case' 0 C--N 1.344 0.341 0 O-C-N 121.659 -0.65 . . . . 0.0 111.308 -179.655 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 20.0 mt -58.67 -37.17 75.43 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.577 -0.702 . . . . 0.0 111.665 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 779' ' ' THR . 1.2 pp -74.11 -34.29 63.88 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.73 -0.607 . . . . 0.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . 0.622 HD11 ' HG ' ' B' ' 774' ' ' LEU . 10.2 pt -70.39 -36.27 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.076 -1.015 . . . . 0.0 110.005 177.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 774' ' ' LEU . 57.9 t -55.11 -46.29 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.678 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.1 t -63.95 -35.64 81.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.484 -0.76 . . . . 0.0 109.581 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 9.7 tpt85 -61.27 -31.88 71.7 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.974 -0.454 . . . . 0.0 110.886 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.687 HG21 HG22 ' C' ' 746' ' ' ILE . 7.1 mm -61.19 -48.04 90.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 O-C-N 122.047 -0.408 . . . . 0.0 110.642 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.678 HG22 ' O ' ' B' ' 779' ' ' THR . 6.2 m -55.31 -38.22 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.504 -0.748 . . . . 0.0 111.11 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.61 -52.24 66.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.404 0.621 . . . . 0.0 110.76 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.1 -44.03 66.47 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.605 0.717 . . . . 0.0 111.966 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.616 HD22 ' ND2' ' C' ' 750' ' ' ASN . 0.1 OUTLIER -73.16 -14.56 61.39 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.682 -178.668 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -54.45 -40.88 70.77 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 11.5 ptp85 -100.93 130.55 46.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.334 0.587 . . . . 0.0 109.995 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.172 -0.918 . . . . 0.0 110.88 -179.228 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.592 HD13 HD12 ' B' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.125 0.488 . . . . 0.0 110.118 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.495 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.3 mp 60.45 123.02 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.723 0.773 . . . . 0.0 111.392 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 178.8 171.29 0.83 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.85 -49.35 76.98 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.174 0.988 . . . . 0.0 109.238 178.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -67.12 -23.07 65.78 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.561 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -48.73 12.06 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.361 0.601 . . . . 0.0 110.071 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -63.44 -45.21 91.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.553 0.692 . . . . 0.0 110.315 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.75 -18.01 65.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.98 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.37 -33.52 67.3 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.923 -0.486 . . . . 0.0 111.778 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.464 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -60.15 -33.95 72.87 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -62.03 -17.58 57.78 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 121.645 -0.659 . . . . 0.0 111.801 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -86.05 -25.21 26.03 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.244 0.545 . . . . 0.0 111.133 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.409 ' CE3' HG21 ' C' ' 675' ' ' ILE . 12.5 m95 -62.84 -40.71 98.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.526 0.679 . . . . 0.0 110.237 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 58.35 34.67 24.23 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.093 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -161.03 -69.08 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.531 -0.731 . . . . 0.0 112.274 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.716 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -59.07 -37.81 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 111.168 -178.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.72 -33.91 50.13 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.977 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' C' ' 681' ' ' TYR . 10.2 m120 -65.69 -50.41 65.0 Favored 'General case' 0 C--O 1.223 -0.332 0 O-C-N 121.927 -0.483 . . . . 0.0 110.722 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.465 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -65.47 -44.24 87.8 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.489 0.661 . . . . 0.0 109.797 178.764 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.628 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.14 -35.63 81.41 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.884 -178.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -101.53 -9.77 20.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' C' ' 677' ' ' ASN . 3.1 m-85 -92.09 -21.37 20.49 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.475 -0.765 . . . . 0.0 111.201 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.545 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.2 pt -60.71 -37.05 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.822 0.344 . . . . 0.0 110.16 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 -56.9 -47.3 80.84 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.481 0.658 . . . . 0.0 109.798 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.17 -34.16 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -60.68 -29.91 69.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.469 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.868 HG21 HD12 ' A' ' 686' ' ' ILE . 10.0 mm -60.84 -47.89 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.429 0.633 . . . . 0.0 109.415 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -61.62 -40.38 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.82 -37.68 67.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.536 HG23 ' O ' ' C' ' 685' ' ' PHE . 85.0 t -55.61 -41.12 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.55 -40.35 77.92 Favored Glycine 0 C--N 1.345 1.067 0 N-CA-C 108.813 -1.715 . . . . 0.0 108.813 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.1 -40.23 86.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.052 0.93 . . . . 0.0 109.373 177.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.403 HD23 HG12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -60.56 -46.68 89.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.576 -178.121 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.8 pp -68.53 -41.91 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 121.25 0.548 . . . . 0.0 110.375 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.609 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.28 -32.32 76.44 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 178.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.655 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.8 tt -60.08 -37.46 79.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.062 0.934 . . . . 0.0 110.158 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -55.98 -28.57 57.69 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.609 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.56 -35.42 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.254 -0.904 . . . . 0.0 110.644 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.668 ' O ' HG22 ' C' ' 701' ' ' VAL . 7.5 p -53.97 -29.23 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.728 -0.607 . . . . 0.0 110.621 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -54.9 -29.3 55.55 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.732 -0.605 . . . . 0.0 110.533 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.07 -37.63 74.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.668 HG22 ' O ' ' C' ' 698' ' ' VAL . 3.2 m -68.87 -35.77 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-O 121.645 0.736 . . . . 0.0 109.372 177.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.12 -37.88 84.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.035 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 22.0 m -62.97 -36.35 83.2 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.248 0.547 . . . . 0.0 110.408 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.1 -40.67 94.88 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.304 1.05 . . . . 0.0 108.841 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.434 HG22 HD23 ' C' ' 748' ' ' LEU . 87.3 t -65.36 -45.1 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 3.2 m120 -63.05 -36.91 85.15 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.021 0.915 . . . . 0.0 110.793 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.417 ' HD3' ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -60.04 -51.21 70.61 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.353 1.073 . . . . 0.0 110.596 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -78.3 -45.96 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.555 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.52 -40.24 61.88 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' C' ' 706' ' ' ASN . 0.0 OUTLIER -101.79 -21.44 14.6 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-O 121.665 0.745 . . . . 0.0 112.347 -176.572 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.46 -170.46 18.4 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -134.51 -53.36 0.83 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.863 -0.786 . . . . 0.0 112.059 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.446 ' HA ' HG21 ' B' ' 708' ' ' VAL . 0.9 OUTLIER -73.55 145.76 85.26 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.178 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . 0.453 ' HD3' HG21 ' B' ' 708' ' ' VAL . 71.2 Cg_exo -36.07 110.25 0.07 OUTLIER 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.268 1.979 . . . . 0.0 112.397 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.507 ' N ' HD22 ' C' ' 715' ' ' LEU . 2.9 mm? -74.35 -20.03 60.24 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -177.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . 0.468 ' C ' ' O ' ' C' ' 715' ' ' LEU . 67.7 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 122.058 0.932 . . . . 0.0 113.082 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 122.151 0.976 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -58.52 -26.31 63.36 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.095 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -55.23 -10.42 0.56 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -75.76 -27.74 58.18 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.549 -0.72 . . . . 0.0 111.687 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -58.55 -44.07 89.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.389 0.614 . . . . 0.0 109.786 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -71.16 -36.08 71.88 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . 0.717 ' O ' HD12 ' C' ' 748' ' ' LEU . 9.6 t -56.78 -38.71 72.88 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.687 HG22 HG21 ' B' ' 781' ' ' ILE . 6.0 mt -52.97 -22.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.84 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -59.35 -27.6 66.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.761 HD13 ' N ' ' C' ' 749' ' ' VAL . 0.0 OUTLIER -57.03 -22.54 39.65 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 122.185 -0.322 . . . . 0.0 111.606 179.247 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . 0.761 ' N ' HD13 ' C' ' 748' ' ' LEU . 83.5 t -55.41 -54.25 27.22 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.616 ' ND2' HD22 ' B' ' 785' ' ' LEU . 1.9 m-80 -72.77 -32.03 65.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.166 -1.379 . . . . 0.0 108.792 174.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.46 -20.65 38.52 Favored Glycine 0 C--N 1.341 0.834 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.806 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 80.6 p -58.77 -37.97 77.45 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.766 -0.843 . . . . 0.0 109.025 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.8 tp -67.34 -48.15 68.37 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.764 0.792 . . . . 0.0 109.986 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.14 77.13 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.427 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.7 tt -59.29 -45.32 91.59 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.858 -0.526 . . . . 0.0 111.976 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 3.2 pt -73.96 -32.88 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.32 0.581 . . . . 0.0 109.822 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -69.29 -30.32 68.39 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.805 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -55.71 -49.01 74.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.347 -0.846 . . . . 0.0 109.907 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -70.2 -44.45 68.66 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.362 0.601 . . . . 0.0 111.29 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.4 -40.6 97.01 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 111.463 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -78.45 -32.81 48.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.022 0.439 . . . . 0.0 111.405 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 37.5 t -66.63 -43.27 85.13 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.282 1.039 . . . . 0.0 110.063 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.495 HD23 HD11 ' C' ' 771' ' ' LEU . 3.2 tp -64.88 -53.57 44.59 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.08 -0.964 . . . . 0.0 113.387 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.532 ' HB2' HD12 ' C' ' 771' ' ' LEU . 23.3 t -97.82 -20.51 17.48 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 64.29 -75.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.745 0.307 . . . . 0.0 110.5 -177.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -108.5 -72.93 0.7 Allowed 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.476 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 23.6 t -133.86 175.71 9.21 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.518 0.675 . . . . 0.0 111.332 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -58.39 -38.3 77.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.152 0.501 . . . . 0.0 110.584 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -53.34 -46.49 69.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 122.105 0.955 . . . . 0.0 108.8 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 48.2 ttm-85 -72.45 -29.57 63.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.953 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' C' ' 764' ' ' SER . 7.5 tt -58.68 -29.66 66.78 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -178.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -56.39 -32.69 65.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -69.36 -34.52 74.7 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 118.382 -1.327 . . . . 0.0 109.666 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.595 HD21 ' CZ ' ' A' ' 742' ' ' ARG . 0.2 OUTLIER -59.93 -38.42 82.33 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.35 -36.08 72.9 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.324 1.059 . . . . 0.0 108.304 176.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -37.6 65.82 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.221 178.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.591 HD12 HD22 ' C' ' 774' ' ' LEU . 23.1 mt -63.64 -44.92 98.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.501 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.565 ' O ' HG13 ' C' ' 782' ' ' VAL . 34.5 m -66.25 -40.86 87.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.229 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.425 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.1 m -63.14 -47.14 84.0 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.984 0.421 . . . . 0.0 111.881 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -39.23 83.93 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.813 -0.554 . . . . 0.0 111.871 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.405 ' HB ' HG21 ' A' ' 746' ' ' ILE . 94.3 mt -68.95 -41.94 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.768 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.781 HG12 HG21 ' A' ' 749' ' ' VAL . 26.4 m -55.89 -38.05 50.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.744 0 CA-C-N 119.773 1.169 . . . . 0.0 109.418 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 . . . . . 0 C--N 1.344 0.359 0 CA-C-O 121.699 0.762 . . . . 0.0 110.052 178.804 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.586 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 28.1 mt 77.61 112.23 0.07 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.989 0.9 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -176.29 -175.76 0.72 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.507 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.2 tt -56.07 -42.17 76.27 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.61 -0.681 . . . . 0.0 110.216 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.02 -34.48 64.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.125 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -73.96 -46.03 46.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.105 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -70.03 -45.95 66.1 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.976 0.417 . . . . 0.0 110.934 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.78 -26.55 65.27 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.985 0.421 . . . . 0.0 111.886 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.6 m -69.29 -32.26 71.29 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.292 0.568 . . . . 0.0 111.195 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.47 -31.71 72.48 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.447 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -59.61 -21.95 61.13 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.031 0.443 . . . . 0.0 111.267 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -75.09 -20.75 59.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.093 0.473 . . . . 0.0 111.432 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.83 -42.57 99.19 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.436 0.636 . . . . 0.0 110.973 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.4 t80 60.22 39.75 18.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.838 0.828 . . . . 0.0 110.848 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -160.98 -67.2 0.06 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.842 -0.536 . . . . 0.0 111.296 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.19 -37.13 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 122.131 -0.356 . . . . 0.0 111.83 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.0 m -52.31 -34.36 46.66 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -177.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -65.02 -49.89 68.41 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 121.507 0.67 . . . . 0.0 109.83 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.4 t90 -65.6 -41.22 93.02 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.675 0.75 . . . . 0.0 110.146 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.423 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -66.17 -36.44 83.11 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.283 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -94.56 -40.16 10.0 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -74.12 -2.7 25.65 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.692 -0.63 . . . . 0.0 112.556 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.685 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.98 -36.94 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 121.646 -0.659 . . . . 0.0 110.284 179.458 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.685 ' H ' HD12 ' A' ' 682' ' ' ILE . 5.9 ttt-85 -59.49 -47.26 86.19 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.009 -0.432 . . . . 0.0 110.584 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.411 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -66.76 -34.6 71.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.42 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.4 OUTLIER -59.95 -32.05 70.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.483 -179.544 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 1.004 HD12 HG21 ' C' ' 686' ' ' ILE . 15.7 mm -60.61 -46.73 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.988 0.423 . . . . 0.0 110.216 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 83.8 mt -60.78 -40.36 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.92 -37.03 70.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.107 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 685' ' ' PHE . 97.9 t -54.58 -40.02 48.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.6 -39.94 95.75 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.9 m -63.4 -38.44 91.14 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.806 0.812 . . . . 0.0 109.694 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.6 -43.95 93.55 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.327 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.866 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -68.31 -42.05 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.007 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.03 -22.5 57.94 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.91 -37.72 85.69 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.999 0.904 . . . . 0.0 109.306 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 2.4 mmt180 -55.51 -28.16 53.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.569 0.748 . . . . 0.0 111.618 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.03 -39.19 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 O-C-N 121.292 -0.88 . . . . 0.0 108.794 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.805 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.53 -31.26 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 O-C-N 121.582 -0.699 . . . . 0.0 110.184 177.219 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.422 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 3.1 m-85 -56.01 -28.91 59.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.962 0.411 . . . . 0.0 110.607 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.48 -37.43 72.91 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.805 HG22 ' O ' ' A' ' 698' ' ' VAL . 10.3 m -59.29 -35.87 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.539 0.685 . . . . 0.0 109.313 177.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.4 -37.81 62.82 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.525 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.5 m -62.65 -39.49 94.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.607 0.718 . . . . 0.0 110.091 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.576 HD22 HH22 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.03 -41.93 97.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.558 1.17 . . . . 0.0 108.804 178.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 99.0 t -68.87 -37.07 76.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.317 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.56 -39.92 95.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.034 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.576 HH22 HD22 ' A' ' 704' ' ' LEU . 5.2 ttm105 -57.36 -48.44 79.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 122.348 1.071 . . . . 0.0 110.349 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -72.94 -44.53 57.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.022 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -73.33 -14.47 61.3 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -178.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 8.35 44.47 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 73.14 20.79 80.06 Favored Glycine 0 CA--C 1.541 1.687 0 O-C-N 121.665 -0.647 . . . . 0.0 112.131 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 68.22 -129.29 0.12 Allowed 'General case' 0 CA--C 1.568 1.635 0 O-C-N 121.868 -0.783 . . . . 0.0 111.272 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 5.5 p -62.62 159.26 44.54 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 120.974 -1.078 . . . . 0.0 111.206 -178.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -45.15 97.96 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.46 1.44 . . . . 0.0 112.127 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.61 -20.41 16.35 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.423 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.85 0 O-C-N 121.766 -0.584 . . . . 0.0 112.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 121.917 0.865 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.7 mtt-85 -58.63 -26.33 63.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.746 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -54.85 -16.97 3.02 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.8 -0.563 . . . . 0.0 111.225 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.532 ' O ' HD12 ' A' ' 746' ' ' ILE . 53.1 ttp85 -74.79 -46.01 39.75 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.759 -0.588 . . . . 0.0 110.527 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.91 -45.14 93.51 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.504 0.669 . . . . 0.0 110.587 -178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.41 -36.56 71.38 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 748' ' ' LEU . 98.0 p -62.22 -36.14 81.03 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.703 HG12 HG12 ' C' ' 778' ' ' VAL . 1.2 mp -55.79 -46.76 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 120.577 -1.327 . . . . 0.0 110.283 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.507 HH21 ' ND2' ' A' ' 750' ' ' ASN . 0.0 OUTLIER -64.41 -2.2 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.758 -177.165 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.65 ' O ' HD13 ' A' ' 748' ' ' LEU . 1.7 tm? -59.33 -15.53 16.82 Favored 'General case' 0 C--N 1.368 1.398 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.621 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.304 2.0 t -53.12 -54.0 19.57 Favored 'Isoleucine or valine' 0 C--N 1.345 0.375 0 C-N-CA 125.13 1.372 . . . . 0.0 107.439 178.478 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.621 ' ND2' HG12 ' A' ' 749' ' ' VAL . 1.5 m-80 -73.32 -14.34 61.28 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.324 175.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.608 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -57.16 -19.41 31.54 Favored Glycine 0 C--O 1.222 -0.622 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.519 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 94.0 p -57.64 -37.86 74.06 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 117.803 0.801 . . . . 0.0 109.147 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.4 tp -62.55 -51.07 68.84 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.8 -35.14 79.63 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 112.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.4 tt -59.48 -45.45 91.61 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.002 -0.436 . . . . 0.0 111.963 -177.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.2 mt -61.84 -33.52 58.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.2 -30.49 68.68 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.536 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 5.1 m-20 -55.68 -48.93 74.23 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.319 -0.863 . . . . 0.0 109.271 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -70.64 -43.46 69.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.405 0.622 . . . . 0.0 111.757 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.42 -32.97 74.81 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.308 0.575 . . . . 0.0 112.114 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -74.42 -18.55 60.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.2 t -77.37 -46.4 22.93 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.579 -0.7 . . . . 0.0 111.634 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.745 ' HA ' HD13 ' A' ' 774' ' ' LEU . 8.0 mp -69.09 -55.82 9.59 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -47.24 5.19 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.255 1.026 . . . . 0.0 112.15 -178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.431 ' O ' HD23 ' A' ' 765' ' ' LEU . 3.6 tt 84.22 -52.96 0.12 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.464 -176.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -134.43 -72.6 0.48 Allowed 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.78 -0.575 . . . . 0.0 110.668 178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.9 152.93 19.83 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.884 -0.51 . . . . 0.0 110.323 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.511 ' CE2' HD13 ' A' ' 771' ' ' LEU . 0.2 OUTLIER -67.03 -24.86 66.05 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.942 0.401 . . . . 0.0 110.897 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.18 -42.19 65.99 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.731 0.777 . . . . 0.0 109.54 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -62.95 -30.08 71.29 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.114 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.511 HD13 ' CE2' ' A' ' 768' ' ' TYR . 2.8 tt -59.87 -42.4 93.63 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.859 -0.525 . . . . 0.0 109.709 -178.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -64.72 -33.51 76.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.658 0.742 . . . . 0.0 109.236 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -43.44 98.82 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.919 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.745 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.7 tt -58.38 -38.46 77.36 Favored 'General case' 0 C--N 1.349 0.544 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.172 -179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 13.1 mt -58.44 -36.88 74.34 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.774 -0.579 . . . . 0.0 112.028 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.8 -43.07 72.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.914 -0.491 . . . . 0.0 112.173 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 20.5 pt -65.19 -37.69 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.466 ' HA ' HD12 ' A' ' 781' ' ' ILE . 73.0 t -56.09 -45.42 80.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 O-C-N 121.98 -0.45 . . . . 0.0 110.631 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.827 ' O ' HG22 ' A' ' 782' ' ' VAL . 19.9 p -63.62 -48.39 77.49 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.023 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -67.54 -31.34 71.37 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.629 ' CD1' HD13 ' B' ' 746' ' ' ILE . 36.8 mt -53.66 -36.21 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.827 HG22 ' O ' ' A' ' 779' ' ' THR . 5.2 m -55.63 -37.99 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.368 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -65.45 -44.68 86.51 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 121.503 0.668 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 13.1 tp -69.45 -38.2 77.68 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.158 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.516 0 CA-C-O 121.0 0.429 . . . . 0.0 111.475 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.581 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.5 mm? 63.53 119.6 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.624 0.726 . . . . 0.0 110.055 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 178.57 177.55 0.45 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.479 0.657 . . . . 0.0 110.172 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.485 HD23 ' N ' ' B' ' 664' ' ' ASP . 9.5 tt -48.94 -62.52 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.793 0.806 . . . . 0.0 111.379 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.485 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.0 t70 -64.78 -21.16 66.72 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.408 -178.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -79.97 -43.91 21.19 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.924 -0.485 . . . . 0.0 110.677 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -64.81 -46.09 83.47 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.665 0.745 . . . . 0.0 109.964 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.09 -23.74 67.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.771 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 42.8 p -68.45 -30.84 69.79 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.838 -0.539 . . . . 0.0 111.274 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.0 -33.19 72.86 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.485 0.659 . . . . 0.0 110.779 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 64.3 m95 -59.57 -18.87 44.43 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.366 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -84.92 -29.5 25.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.343 0.592 . . . . 0.0 110.744 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.7 m95 -57.6 -47.56 81.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.354 0.597 . . . . 0.0 110.74 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 18.8 t80 59.52 28.11 17.43 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.334 0.588 . . . . 0.0 111.323 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -138.68 -78.23 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.83 -0.544 . . . . 0.0 111.069 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -64.64 -36.98 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.681 -0.637 . . . . 0.0 111.254 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.81 -34.31 39.6 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.073 -0.392 . . . . 0.0 111.916 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -63.36 -50.15 71.08 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 109.575 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.624 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.6 t90 -65.65 -40.58 92.61 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-O 121.889 0.852 . . . . 0.0 109.879 178.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -35.68 81.61 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -101.83 -47.01 4.74 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -59.0 -15.1 11.45 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.61 -0.681 . . . . 0.0 112.224 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.783 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.3 pp -60.56 -36.28 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.623 -0.673 . . . . 0.0 110.459 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . 0.783 ' N ' HD12 ' B' ' 682' ' ' ILE . 12.9 ttt-85 -53.85 -47.39 71.01 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.442 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -68.68 -37.34 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -28.25 67.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.786 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.707 HD12 HG21 ' A' ' 686' ' ' ILE . 16.9 mm -60.7 -49.6 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 O-C-N 121.781 -0.575 . . . . 0.0 109.924 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.37 -39.59 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.09 -37.95 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.66 -48.4 87.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.16 -26.75 9.51 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 7.4 m -60.06 -43.85 95.14 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.579 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.56 -31.84 69.8 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.413 -0.805 . . . . 0.0 112.374 -177.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.579 ' N ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.05 -46.13 84.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.452 -0.78 . . . . 0.0 109.757 -177.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.73 -31.36 77.79 Favored Glycine 0 CA--C 1.54 1.624 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.455 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.08 -37.19 66.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.906 0.86 . . . . 0.0 110.434 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.866 ' HE ' HD11 ' A' ' 693' ' ' ILE . 17.3 mmt180 -55.14 -28.23 51.17 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.703 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.53 -36.55 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 O-C-N 120.813 -1.179 . . . . 0.0 108.665 -178.208 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.455 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.4 -30.84 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.418 -0.801 . . . . 0.0 109.65 176.472 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.7 m-85 -56.37 -30.64 62.95 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.759 -0.588 . . . . 0.0 109.724 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.64 -37.4 75.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -43.16 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -59.69 -37.97 80.28 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.121 0.486 . . . . 0.0 109.767 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.3 m -62.76 -32.96 74.21 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.219 0.533 . . . . 0.0 109.594 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.1 OUTLIER -64.18 -40.59 96.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.052 0.929 . . . . 0.0 108.617 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.495 HG22 HD22 ' B' ' 748' ' ' LEU . 58.6 t -67.88 -46.17 82.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.564 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.87 -36.61 83.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.8 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.34 -50.18 55.11 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -41.98 30.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.645 0.736 . . . . 0.0 112.434 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -58.01 -44.99 87.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.514 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.413 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.2 pt20 -104.61 -25.0 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.333 1.063 . . . . 0.0 113.24 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.95 153.55 8.0 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.511 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -85.85 -33.24 21.35 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 122.05 -0.676 . . . . 0.0 112.135 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.02 155.43 52.49 Favored Pre-proline 0 N--CA 1.471 0.601 0 CA-C-O 118.454 -0.784 . . . . 0.0 109.663 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 708' ' ' VAL . 59.8 Cg_exo -36.83 138.24 0.23 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.809 1.673 . . . . 0.0 112.285 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' B' ' 716' ' ' SER . 11.4 tp -100.55 -19.3 16.22 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 715' ' ' LEU . 6.9 t . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 122.346 1.07 . . . . 0.0 112.756 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.547 0.833 0 CA-C-O 122.045 0.926 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 3.1 ttp85 -72.42 -26.22 61.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.898 0.856 . . . . 0.0 111.454 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.32 -6.09 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -176.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.829 ' O ' HD12 ' B' ' 746' ' ' ILE . 60.8 mtm-85 -55.33 -39.11 69.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.248 0.931 . . . . 0.0 110.492 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.16 -43.72 87.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.165 0.507 . . . . 0.0 109.82 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.3 -42.86 68.14 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.567 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 93.8 p -56.54 -37.75 70.93 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.862 -0.524 . . . . 0.0 110.903 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.829 HD12 ' O ' ' B' ' 742' ' ' ARG . 1.4 mp -58.99 -10.28 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.836 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.429 ' HD2' ' HG3' ' C' ' 714' ' ' PRO . 0.0 OUTLIER -59.0 -27.11 65.12 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 121.211 -0.93 . . . . 0.0 108.863 177.683 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.495 HD22 HG22 ' B' ' 705' ' ' VAL . 33.9 tp -54.47 -21.91 11.27 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.643 -177.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 92.4 t -55.39 -54.29 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -73.02 -24.7 60.76 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.282 174.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.95 -19.76 31.25 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.025 -0.989 . . . . 0.0 113.159 -176.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 35.6 t -58.17 -37.63 75.08 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.387 1.094 . . . . 0.0 108.993 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 33.1 tp -69.27 -51.07 41.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.152 0.501 . . . . 0.0 110.595 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.63 76.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.78 -45.37 92.51 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.574 -0.704 . . . . 0.0 111.852 -176.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . 0.41 HG22 HD12 ' B' ' 760' ' ' LEU . 32.1 mm -64.99 -31.2 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.584 0.707 . . . . 0.0 109.24 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.39 68.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.947 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.21 -49.15 72.67 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.295 -0.878 . . . . 0.0 108.755 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.67 -44.6 66.69 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.455 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . 0.41 HD12 HG22 ' B' ' 756' ' ' ILE . 24.6 mt -68.1 -46.27 71.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -177.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -63.38 -42.77 98.86 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . 0.406 ' O ' HD22 ' B' ' 774' ' ' LEU . 2.1 p -68.42 -45.45 72.58 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.443 0.639 . . . . 0.0 111.073 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.446 HD23 HD11 ' B' ' 771' ' ' LEU . 0.2 OUTLIER -68.67 -53.75 20.45 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.829 -0.544 . . . . 0.0 112.39 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.9 p -98.03 -49.35 4.79 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 76.89 92.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.898 0.856 . . . . 0.0 110.412 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 3.1 t80 71.45 -72.93 0.1 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.177 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 19.2 p -98.67 163.28 12.71 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.743 -0.598 . . . . 0.0 111.376 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.87 -33.51 21.24 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.661 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.81 -38.11 64.23 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 122.167 0.984 . . . . 0.0 109.156 178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 9.6 tpt85 -59.27 -29.64 67.72 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.856 178.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.446 HD11 HD23 ' B' ' 763' ' ' LEU . 8.0 tt -59.61 -37.73 79.39 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 110.706 -178.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -58.53 -35.62 72.57 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.128 0.49 . . . . 0.0 110.081 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -69.25 -48.98 60.32 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.138 0.494 . . . . 0.0 110.188 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.413 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.1 OUTLIER -61.4 -37.73 84.5 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.747 0.784 . . . . 0.0 110.137 179.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.62 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.6 OUTLIER -57.69 -36.92 72.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.58 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.15 -33.28 69.9 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 122.19 -0.319 . . . . 0.0 111.45 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 6.3 pt -70.15 -36.88 69.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 O-C-N 121.839 -0.538 . . . . 0.0 110.317 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.413 HG23 ' O ' ' B' ' 774' ' ' LEU . 41.6 t -59.72 -46.19 93.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 O-C-N 121.526 -0.734 . . . . 0.0 110.344 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.791 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.2 t -63.33 -48.18 79.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.934 -0.479 . . . . 0.0 112.226 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.5 -31.68 71.96 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.756 -0.59 . . . . 0.0 111.445 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 22.6 mt -58.34 -36.32 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 121.88 -0.513 . . . . 0.0 110.652 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.791 HG22 ' O ' ' B' ' 779' ' ' THR . 5.9 m -53.87 -38.26 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 O-C-N 121.593 -0.692 . . . . 0.0 110.246 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.28 -41.61 96.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.4 0.619 . . . . 0.0 110.573 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.73 -44.13 97.5 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.295 0.569 . . . . 0.0 110.954 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 30.3 tp -79.51 -24.95 41.91 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.007 0.432 . . . . 0.0 110.64 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.51 -43.04 10.43 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -97.78 113.66 25.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.686 0.755 . . . . 0.0 109.776 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.348 -178.564 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 122.398 1.094 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.54 169.26 24.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.884 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -174.58 167.41 3.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.572 0.701 . . . . 0.0 110.532 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.588 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.2 OUTLIER -56.2 -48.69 75.9 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.067 0.937 . . . . 0.0 109.375 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.588 ' N ' HD13 ' C' ' 663' ' ' LEU . 9.4 t70 -67.2 -28.96 68.51 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.396 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -71.22 -48.74 49.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.028 0.442 . . . . 0.0 111.018 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -56.84 -46.19 81.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.217 0.532 . . . . 0.0 110.486 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.35 85.65 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.185 0.516 . . . . 0.0 111.448 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 25.5 p -57.78 -34.5 69.65 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.138 0.495 . . . . 0.0 111.293 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 14.8 mt -60.52 -29.06 68.87 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.139 -0.351 . . . . 0.0 111.293 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 51.1 m95 -60.91 -21.11 63.05 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.909 -0.495 . . . . 0.0 110.993 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -84.98 -5.76 59.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 121.03 0.443 . . . . 0.0 111.352 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.43 ' O ' HG22 ' C' ' 675' ' ' ILE . 13.9 m95 -89.86 30.65 1.03 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.323 0.582 . . . . 0.0 110.617 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -16.56 135.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 91.52 -48.93 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.688 1.595 . . . . 0.0 111.651 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.662 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.82 -42.39 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.535 0.683 . . . . 0.0 111.571 -179.34 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.73 -33.69 49.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.568 -178.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -60.11 -49.92 75.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.391 0.615 . . . . 0.0 109.704 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.8 OUTLIER -65.81 -42.76 90.25 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.685 0.755 . . . . 0.0 109.693 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.466 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -63.31 -35.8 81.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.391 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -101.61 -23.27 14.29 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -83.09 -16.07 48.33 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.374 -0.829 . . . . 0.0 112.22 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.5 pp -60.53 -36.47 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 O-C-N 122.043 -0.411 . . . . 0.0 110.226 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.645 ' N ' HD12 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -59.88 -46.86 87.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.75 0.786 . . . . 0.0 109.789 179.397 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.434 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -73.18 -31.33 34.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 CA-C-O 121.423 0.63 . . . . 0.0 109.71 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -28.28 68.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.436 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 1.004 HG21 HD12 ' A' ' 686' ' ' ILE . 8.3 mm -61.79 -42.74 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 121.41 0.624 . . . . 0.0 109.562 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 66.4 mt -65.19 -37.64 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.92 -38.23 72.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 81.6 t -55.7 -40.41 60.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . 0.424 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.13 -40.43 74.42 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 177.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.6 m -66.35 -38.32 87.34 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.019 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.0 tp -60.21 -46.32 90.16 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.572 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.424 HG13 ' O ' ' C' ' 690' ' ' GLY . 1.9 pp -67.88 -41.8 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 O-C-N 121.928 -0.483 . . . . 0.0 111.005 -178.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.698 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.39 -26.57 64.36 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.9 tt -66.07 -38.74 89.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.938 0.875 . . . . 0.0 110.138 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.15 -28.69 58.97 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.698 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.2 tt -58.77 -35.36 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 O-C-N 121.416 -0.802 . . . . 0.0 110.99 -176.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.9 p -53.89 -29.77 18.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 O-C-N 121.495 -0.753 . . . . 0.0 110.474 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -55.91 -31.68 63.1 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.873 -0.517 . . . . 0.0 110.268 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.82 -37.64 79.76 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -45.13 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -56.69 -39.12 73.25 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.753 178.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.4 m -63.33 -38.84 92.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.997 0.427 . . . . 0.0 110.144 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.447 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.2 OUTLIER -63.19 -41.98 99.28 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.741 HG13 HD21 ' C' ' 748' ' ' LEU . 98.8 t -61.69 -45.61 98.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.84 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.274 1.035 . . . . 0.0 111.055 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.413 ' HD2' ' C ' ' C' ' 707' ' ' ARG . 5.6 tmm_? -57.08 -51.06 70.79 Favored 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 121.301 -0.874 . . . . 0.0 110.654 -177.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -44.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -73.05 -44.19 61.03 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -103.28 -22.05 13.76 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.52 164.74 11.62 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' B' ' 704' ' ' LEU . 31.4 p90 -114.08 -47.62 2.94 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.474 0.654 . . . . 0.0 111.779 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 9.7 p -97.99 159.5 30.68 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . 0.429 ' HG3' ' HD2' ' B' ' 747' ' ' ARG . 27.3 Cg_exo -33.47 121.35 0.12 Allowed 'Trans proline' 0 N--CA 1.5 1.86 0 C-N-CA 122.19 1.927 . . . . 0.0 112.424 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.76 16.61 23.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 O-C-N 121.004 -1.06 . . . . 0.0 110.031 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 N--CA 1.467 0.419 0 CA-C-O 121.935 0.874 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 17.8 tpt85 -64.26 -30.73 71.77 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.333 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.75 -34.03 64.83 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.039 0.447 . . . . 0.0 111.05 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -58.1 -37.41 74.47 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.191 -0.318 . . . . 0.0 111.635 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -58.27 -39.28 78.81 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.461 -0.774 . . . . 0.0 108.975 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -36.46 71.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.376 177.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 54.2 p -61.7 -44.8 96.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.9 -0.5 . . . . 0.0 110.924 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.57 -28.67 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.286 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 4.9 mtm105 -59.81 -22.81 62.7 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.55 -0.719 . . . . 0.0 110.021 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.741 HD21 HG13 ' C' ' 705' ' ' VAL . 0.1 OUTLIER -67.11 -18.58 65.37 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.031 0.444 . . . . 0.0 110.18 178.427 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 46.4 t -55.74 -54.66 23.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.579 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -72.9 -21.07 60.97 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.338 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.86 -20.19 32.25 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.518 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.1 p -58.15 -37.62 74.99 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.909 -0.76 . . . . 0.0 109.103 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 13.6 tp -65.63 -51.32 60.48 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.01 -34.91 72.43 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.356 0.598 . . . . 0.0 111.854 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.476 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.5 tt -59.04 -45.34 90.98 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.0 0.429 . . . . 0.0 111.302 -177.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 50.9 mt -72.08 -37.28 59.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.509 0.671 . . . . 0.0 109.689 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.33 -31.42 69.85 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.78 -45.88 78.05 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.146 -0.971 . . . . 0.0 110.241 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . 0.721 ' O ' HD12 ' C' ' 763' ' ' LEU . 22.8 t70 -70.29 -42.86 71.5 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.427 0.632 . . . . 0.0 110.976 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.31 -36.81 83.88 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -82.41 -31.37 29.64 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 68.9 m -73.37 -45.84 52.62 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.538 -0.726 . . . . 0.0 112.751 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.77 HD13 ' H ' ' C' ' 764' ' ' SER . 0.0 OUTLIER -68.57 -39.0 81.2 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.689 -0.632 . . . . 0.0 112.61 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.77 ' H ' HD13 ' C' ' 763' ' ' LEU . 4.9 m -91.26 -34.27 15.03 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.832 -0.543 . . . . 0.0 111.53 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.06 60.88 1.43 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 122.304 1.05 . . . . 0.0 109.438 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.6 t80 60.53 160.53 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.327 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 50.4 m 55.69 -160.02 0.2 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -132.83 -34.39 1.14 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.371 -0.83 . . . . 0.0 110.463 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -53.5 -27.55 26.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.682 0.753 . . . . 0.0 109.888 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.48 -30.14 65.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.46 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.564 HD12 HD21 ' C' ' 763' ' ' LEU . 6.2 tt -59.66 -30.84 69.03 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.842 -0.536 . . . . 0.0 110.038 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -32.83 67.76 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.657 0.742 . . . . 0.0 109.2 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.33 -34.37 77.56 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.516 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.519 HD13 ' HA ' ' C' ' 763' ' ' LEU . 9.0 tp -57.88 -38.35 75.62 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 121.804 -0.56 . . . . 0.0 110.287 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 49.8 mt -58.44 -39.47 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.769 0.795 . . . . 0.0 109.814 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.56 -41.69 60.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.666 0.746 . . . . 0.0 110.691 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.13 -41.57 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.02 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.703 HG12 HG12 ' A' ' 746' ' ' ILE . 27.9 m -65.09 -39.69 86.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 O-C-N 121.514 -0.741 . . . . 0.0 110.766 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.759 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.0 OUTLIER -63.72 -45.19 91.07 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 122.041 -0.412 . . . . 0.0 111.489 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -31.63 71.62 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.552 HD13 ' HB ' ' A' ' 746' ' ' ILE . 61.4 mt -64.54 -39.44 85.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 119.051 -0.5 . . . . 0.0 112.157 -178.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.759 HG22 ' O ' ' C' ' 779' ' ' THR . 29.2 m -53.16 -37.95 29.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 CA-C-N 119.846 1.203 . . . . 0.0 110.126 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 121.157 0.503 . . . . 0.0 111.446 179.886 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.658 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.8 tp . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 61.4 mt 56.32 92.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.861 0.838 . . . . 0.0 110.927 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -164.58 178.14 7.57 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.054 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.464 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.9 tt -54.79 -43.93 73.28 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.579 0.704 . . . . 0.0 110.441 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.38 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -73.95 -45.46 50.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.197 0.522 . . . . 0.0 110.943 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -70.18 -46.34 64.81 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.803 0.335 . . . . 0.0 111.174 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.75 -28.38 68.99 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.022 0.439 . . . . 0.0 112.159 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.3 t -65.35 -36.84 85.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.367 0.603 . . . . 0.0 111.022 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.5 HD23 ' OG1' ' A' ' 676' ' ' THR . 0.7 OUTLIER -65.48 -23.65 66.96 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -59.62 -27.85 66.68 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.497 -0.752 . . . . 0.0 111.508 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -67.46 -24.03 65.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.883 -0.51 . . . . 0.0 111.625 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -54.96 -47.58 74.34 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.232 0.539 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 76.3 t80 60.77 7.49 1.46 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -118.01 -73.77 0.63 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.172 -0.955 . . . . 0.0 111.091 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.62 HG12 HD23 ' A' ' 679' ' ' LEU . 5.7 tt -68.06 -36.02 73.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 O-C-N 121.959 -0.463 . . . . 0.0 111.78 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.5 ' OG1' HD23 ' A' ' 669' ' ' LEU . 4.3 m -50.99 -33.58 25.35 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 122.033 -0.417 . . . . 0.0 111.351 -176.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.88 -49.2 75.79 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.544 0.688 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.545 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -65.51 -44.29 87.46 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 121.659 -0.651 . . . . 0.0 110.498 179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.62 HD23 HG12 ' A' ' 675' ' ' ILE . 3.4 mm? -66.18 -39.36 89.66 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.2 t90 -89.27 -8.49 53.3 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -107.67 -8.5 16.1 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.551 -0.718 . . . . 0.0 111.833 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 678' ' ' TRP . 1.6 pt -60.53 -36.67 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 121.665 -0.647 . . . . 0.0 109.412 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.6 ttt-85 -53.45 -47.14 69.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 109.814 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.18 -36.09 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.451 ' O ' HG23 ' A' ' 689' ' ' VAL . 1.2 t80 -59.83 -28.59 67.61 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.485 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 14.1 mm -61.67 -51.98 66.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.358 0.599 . . . . 0.0 109.76 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.18 -36.46 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.728 0.775 . . . . 0.0 109.384 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -36.95 58.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.9 t -54.06 -40.07 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.21 -39.67 82.08 Favored Glycine 0 CA--C 1.532 1.119 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.28 -38.51 85.18 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.116 0.96 . . . . 0.0 109.596 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.64 -46.12 89.97 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.172 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.55 HG21 HG22 ' B' ' 693' ' ' ILE . 1.4 pp -68.15 -43.29 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 122.045 -0.41 . . . . 0.0 111.333 -177.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.68 -23.43 60.88 Favored Glycine 0 CA--C 1.54 1.596 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.31 -37.98 79.11 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.256 1.027 . . . . 0.0 108.957 178.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.674 ' HG3' HD11 ' C' ' 693' ' ' ILE . 15.5 mmt180 -55.99 -28.45 57.24 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.599 0.76 . . . . 0.0 112.541 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.36 -41.27 83.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.366 -0.833 . . . . 0.0 109.206 -177.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.755 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.51 -30.37 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.501 -0.75 . . . . 0.0 109.956 177.135 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.49 -28.56 55.31 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.255 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -37.01 71.3 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.9 m -58.83 -36.76 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 O-C-N 121.59 -0.694 . . . . 0.0 109.316 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -56.15 -38.22 70.55 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 19.4 m -64.06 -39.3 93.78 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-O 121.563 0.697 . . . . 0.0 109.922 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.503 HD22 ' NH1' ' A' ' 707' ' ' ARG . 0.5 OUTLIER -60.84 -44.72 96.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.571 1.176 . . . . 0.0 108.533 178.337 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.984 HG22 HD11 ' A' ' 748' ' ' LEU . 40.1 t -64.36 -42.86 96.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 114.411 -1.268 . . . . 0.0 109.128 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.59 -42.12 99.37 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.285 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.503 ' NH1' HD22 ' A' ' 704' ' ' LEU . 8.6 mtm105 -60.89 -45.8 93.17 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.138 0.971 . . . . 0.0 111.474 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.435 HG21 ' HA ' ' B' ' 713' ' ' SER . 3.0 t -75.89 -44.66 38.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.221 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -73.76 -14.69 61.16 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -16.23 28.66 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.04 -1.037 . . . . 0.0 113.06 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.98 34.36 3.49 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 121.639 -0.663 . . . . 0.0 111.98 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 55.58 -136.03 1.27 Allowed 'General case' 0 CA--C 1.561 1.4 0 O-C-N 122.031 -0.688 . . . . 0.0 110.828 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 17.1 m -62.86 157.76 57.78 Favored Pre-proline 0 C--N 1.35 0.611 0 O-C-N 120.859 -1.151 . . . . 0.0 112.106 -178.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.433 ' HD2' HG21 ' C' ' 708' ' ' VAL . 73.0 Cg_exo -44.6 103.89 0.05 OUTLIER 'Trans proline' 0 N--CA 1.482 0.815 0 C-N-CA 121.763 1.642 . . . . 0.0 112.799 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.541 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.9 pt? -105.95 -20.61 13.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.564 0.697 . . . . 0.0 111.594 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.692 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 C-N-CA 123.378 0.671 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 14.0 ttm-85 -59.3 -26.73 65.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.481 -179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -9.06 0.65 Allowed 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.746 -0.596 . . . . 0.0 112.389 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.4 ttm105 -60.0 -41.73 92.72 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.411 -0.805 . . . . 0.0 109.48 179.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.593 ' HB3' HD12 ' C' ' 781' ' ' ILE . 0.9 OUTLIER -68.08 -41.11 82.38 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.534 0.683 . . . . 0.0 109.335 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -60.04 -46.83 88.23 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.279 -0.888 . . . . 0.0 108.955 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.8 p -69.15 -26.94 65.12 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.55 ' HB ' HG21 ' C' ' 781' ' ' ILE . 30.7 mt -74.89 -47.41 37.43 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-O 116.565 -1.683 . . . . 0.0 112.014 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.514 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.343 14.1 ttt180 -73.45 -3.85 30.04 Favored 'General case' 0 C--N 1.361 1.109 0 CA-C-N 122.721 2.509 . . . . 0.0 111.47 -178.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.984 HD11 HG22 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -56.46 -15.4 4.14 Favored 'General case' 0 CA--C 1.577 1.992 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 169.601 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.568 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.293 1.5 t -53.66 -54.2 20.81 Favored 'Isoleucine or valine' 0 C--N 1.363 1.182 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 175.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.568 ' ND2' HG12 ' A' ' 749' ' ' VAL . 1.6 m-80 -72.52 -22.43 61.03 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.158 -1.383 . . . . 0.0 108.686 175.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.87 -19.39 29.26 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.1 t -57.45 -37.11 72.3 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 51.6 tp -61.31 -49.25 77.76 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.0 -34.75 72.21 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.657 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.474 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.2 tt -58.67 -45.53 89.18 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.876 -0.515 . . . . 0.0 112.189 -176.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 40.3 mt -61.55 -32.24 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.24 -30.38 68.51 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.76 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.71 ' OD2' HD22 ' B' ' 715' ' ' LEU . 6.3 m-20 -55.51 -44.9 77.03 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.855 0.836 . . . . 0.0 109.248 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -70.41 -42.84 71.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.573 0.701 . . . . 0.0 111.372 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 22.6 mt -68.98 -29.85 68.14 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -79.16 -30.13 43.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.9 t -75.26 -45.02 42.71 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.951 0.881 . . . . 0.0 111.61 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.65 ' O ' HD22 ' A' ' 774' ' ' LEU . 0.5 OUTLIER -59.9 -53.59 56.06 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.232 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 3.3 m -97.9 -24.11 15.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.353 -0.842 . . . . 0.0 113.237 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.6 mt 66.55 -73.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.906 0.384 . . . . 0.0 109.989 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -135.8 133.76 38.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 109.516 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m 58.48 168.74 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.506 ' CE1' HD22 ' A' ' 771' ' ' LEU . 5.2 t80 -91.14 -17.56 25.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 120.963 0.411 . . . . 0.0 111.813 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.8 -34.0 77.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.004 0.907 . . . . 0.0 109.773 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -62.64 -29.53 70.7 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.003 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.529 HD11 HD23 ' A' ' 763' ' ' LEU . 40.2 tp -59.61 -45.52 91.68 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.891 -0.506 . . . . 0.0 111.928 -177.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 1.3 ptt85 -64.02 -33.74 76.43 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.708 -0.797 . . . . 0.0 109.45 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.33 -39.59 78.08 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.78 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.65 HD22 ' O ' ' A' ' 763' ' ' LEU . 1.8 tp -59.35 -38.49 80.52 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.971 -0.456 . . . . 0.0 111.2 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.11 -36.75 75.7 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 14.5 mt -67.86 -44.31 77.42 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.475 ' O ' HG13 ' A' ' 781' ' ' ILE . 6.0 pt -58.1 -36.5 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.409 HG22 HD11 ' B' ' 746' ' ' ILE . 91.7 t -53.54 -44.53 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 O-C-N 121.911 -0.493 . . . . 0.0 109.904 -177.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 51.7 p -63.79 -36.8 85.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.117 0.96 . . . . 0.0 109.649 177.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -34.11 76.55 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.832 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 777' ' ' ILE . 55.8 mt -68.76 -42.73 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.664 -0.647 . . . . 0.0 110.86 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.29 -38.55 82.43 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 O-C-N 121.467 -0.77 . . . . 0.0 110.343 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -42.86 91.98 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.713 0.768 . . . . 0.0 109.378 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.69 -37.06 85.42 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.496 0.665 . . . . 0.0 109.821 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.292 0.568 . . . . 0.0 110.251 179.795 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.547 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.547 HD22 ' C ' ' B' ' 660' ' ' LEU . 1.1 mm? 55.61 102.35 0.01 OUTLIER 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.649 0.738 . . . . 0.0 110.392 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.71 176.27 2.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.546 0.689 . . . . 0.0 110.12 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.51 -42.84 61.99 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.465 0.65 . . . . 0.0 110.878 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.67 -36.69 73.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.02 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -71.2 -46.44 61.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.102 0.477 . . . . 0.0 110.864 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -67.46 -45.99 74.36 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.298 0.57 . . . . 0.0 110.89 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -20.14 66.14 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 30.8 t -67.88 -35.28 78.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.168 0.509 . . . . 0.0 110.986 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.1 mm? -59.86 -29.18 68.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.255 0.55 . . . . 0.0 111.304 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 44.7 m95 -60.3 -27.13 67.06 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 0.0 111.624 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -87.91 -10.3 51.04 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.998 -0.439 . . . . 0.0 112.18 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 10.4 m95 -74.55 -54.24 7.87 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.484 0.659 . . . . 0.0 111.015 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.15 27.77 17.28 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.286 0.565 . . . . 0.0 111.358 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -135.86 -78.69 0.42 Allowed 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.622 -0.673 . . . . 0.0 111.435 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.04 -36.87 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-O 121.64 0.733 . . . . 0.0 110.899 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -51.95 -33.18 36.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.357 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -55.96 -47.71 77.11 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.646 -0.659 . . . . 0.0 109.851 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.593 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.0 t90 -59.64 -38.13 80.56 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.879 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.523 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -58.46 -44.41 89.25 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.344 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -87.73 -42.15 12.82 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -65.76 -25.59 67.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.746 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.7 -36.64 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.774 -0.579 . . . . 0.0 110.887 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . 0.746 ' N ' HD12 ' B' ' 682' ' ' ILE . 4.3 ttt-85 -56.93 -47.18 81.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.165 0.507 . . . . 0.0 110.655 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.471 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.62 -34.45 65.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.553 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.82 -29.9 68.56 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.117 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.806 HD12 HG21 ' A' ' 686' ' ' ILE . 12.2 mm -60.85 -49.52 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.199 0.524 . . . . 0.0 109.995 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.26 -42.49 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 88.9 mt -58.79 -37.95 69.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 685' ' ' PHE . 56.0 t -64.75 -46.82 90.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.08 -27.0 9.58 Favored Glycine 0 CA--C 1.541 1.704 0 O-C-N 121.746 -0.596 . . . . 0.0 112.08 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.9 m -60.37 -43.55 96.44 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.557 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -32.23 70.2 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.513 -0.742 . . . . 0.0 112.361 -177.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.557 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.11 -44.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.589 -0.694 . . . . 0.0 109.288 -177.631 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.47 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.97 -32.74 81.15 Favored Glycine 0 CA--C 1.538 1.518 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.512 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -57.24 -37.57 72.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.522 0.677 . . . . 0.0 110.908 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 5.8 mmt180 -55.32 -28.93 56.92 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -59.36 -36.22 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 120.798 -1.189 . . . . 0.0 109.076 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.512 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -62.33 -30.36 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 O-C-N 121.691 -0.631 . . . . 0.0 110.157 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.3 m-85 -56.2 -30.32 62.12 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 121.737 -0.602 . . . . 0.0 109.5 179.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.4 -37.42 75.28 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 177.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 -39.51 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.03 -36.66 73.04 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.533 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 16.5 m -61.8 -35.38 78.02 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 122.055 -0.403 . . . . 0.0 110.917 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.42 -43.76 93.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.23 1.015 . . . . 0.0 108.361 178.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.526 HG22 HD22 ' B' ' 748' ' ' LEU . 53.3 t -64.93 -42.1 93.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.166 178.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.2 m-80 -62.19 -36.58 82.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.22 0.534 . . . . 0.0 110.856 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -68.63 -49.56 58.26 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 122.612 1.196 . . . . 0.0 110.509 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.37 -45.43 29.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -176.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -65.36 -45.94 82.16 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.437 -174.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 9.5 pt20 -105.92 -24.83 12.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.94 179.81 16.64 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -123.79 -63.84 1.19 Allowed 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.787 -0.831 . . . . 0.0 112.307 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . 0.435 ' HA ' HG21 ' A' ' 708' ' ' VAL . 0.4 OUTLIER -63.78 159.29 54.9 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-O 118.562 -0.732 . . . . 0.0 109.738 179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -29.87 117.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.813 2.342 . . . . 0.0 112.703 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.71 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.3 tt -88.75 5.92 41.12 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 122.023 0.916 . . . . 0.0 110.139 179.762 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 122.104 0.954 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -66.03 -26.33 67.47 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.368 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -5.99 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . 0.539 ' HD3' HD21 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -55.08 -33.49 62.8 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.121 -0.987 . . . . 0.0 109.203 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -69.62 -34.03 73.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -47.75 70.03 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.335 178.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . 0.477 ' O ' HD23 ' B' ' 748' ' ' LEU . 14.5 p -56.87 -34.71 68.1 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.463 HG21 ' CG2' ' A' ' 781' ' ' ILE . 0.3 OUTLIER -52.71 -23.71 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.766 178.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -21.63 59.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.526 HD22 HG22 ' B' ' 705' ' ' VAL . 4.0 pp -55.16 -23.52 21.9 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 121.274 0.559 . . . . 0.0 109.543 177.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 7.7 t -55.47 -53.98 30.3 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.451 ' H ' HD22 ' B' ' 750' ' ' ASN . 2.6 m-80 -72.64 -21.5 61.09 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.692 174.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.98 -20.6 34.65 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.745 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.6 -42.19 98.51 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 117.936 0.868 . . . . 0.0 109.801 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 15.7 tp -68.39 -47.31 67.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.977 0.894 . . . . 0.0 110.278 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -66.95 -34.19 77.22 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.784 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . 0.502 ' C ' HD13 ' B' ' 755' ' ' LEU . 2.5 tm? -58.6 -45.26 89.52 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.918 -0.489 . . . . 0.0 111.815 -176.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . 0.479 HG22 HD12 ' B' ' 760' ' ' LEU . 4.1 mp -72.08 -35.1 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.19 -30.8 69.08 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.66 ' CG ' HD22 ' C' ' 715' ' ' LEU . 10.6 m-20 -55.59 -45.4 77.42 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 120.734 -1.229 . . . . 0.0 109.271 -179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.67 -46.19 63.68 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . 0.479 HD12 HG22 ' B' ' 756' ' ' ILE . 44.9 mt -69.77 -46.24 66.24 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -49.97 75.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . 0.418 ' O ' HD13 ' B' ' 774' ' ' LEU . 20.1 p -73.28 -38.33 65.96 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.635 0.731 . . . . 0.0 111.268 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.474 HD23 HD12 ' B' ' 771' ' ' LEU . 0.8 OUTLIER -65.61 -53.11 46.22 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 34.8 p -98.07 -49.13 4.87 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.516 -0.74 . . . . 0.0 112.041 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' B' ' 765' ' ' LEU . 0.3 OUTLIER 77.52 89.0 0.07 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 122.067 0.936 . . . . 0.0 111.337 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 62.62 -74.74 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.823 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 41.0 t -84.64 162.49 19.72 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.527 0.679 . . . . 0.0 111.747 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -23.18 18.01 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.631 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -67.7 -39.82 84.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 122.059 0.933 . . . . 0.0 109.004 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -58.83 -28.94 66.51 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.46 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . 0.474 HD12 HD23 ' B' ' 763' ' ' LEU . 2.6 tt -58.55 -30.72 67.34 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 9.3 mmt-85 -59.89 -32.88 71.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.64 -48.66 66.08 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.618 HD11 ' CZ ' ' C' ' 742' ' ' ARG . 0.4 OUTLIER -59.18 -37.8 78.27 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.3 1.048 . . . . 0.0 109.662 178.287 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -58.34 -36.37 73.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.445 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 66.1 mt -73.86 -31.71 63.31 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.615 -0.678 . . . . 0.0 112.236 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . 0.443 HD11 HH22 ' C' ' 742' ' ' ARG . 8.3 pt -70.35 -37.29 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.541 -0.725 . . . . 0.0 111.305 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.403 HG22 ' O ' ' B' ' 775' ' ' LEU . 35.5 m -66.08 -40.21 86.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.271 -0.893 . . . . 0.0 110.936 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.4 t -63.68 -47.41 81.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.803 -0.561 . . . . 0.0 112.081 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.7 82.1 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.699 -0.626 . . . . 0.0 111.695 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.418 HD12 ' O ' ' B' ' 777' ' ' ILE . 65.5 mt -63.97 -43.59 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 O-C-N 122.088 -0.383 . . . . 0.0 111.32 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.575 HG11 HG11 ' C' ' 749' ' ' VAL . 18.8 m -59.48 -38.24 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.48 -0.762 . . . . 0.0 109.8 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.32 -42.9 99.43 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.599 0.714 . . . . 0.0 109.674 179.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.62 -42.43 95.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.332 0.586 . . . . 0.0 110.832 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' C' ' 747' ' ' ARG . 10.9 tp -82.15 -14.58 55.47 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.041 0.448 . . . . 0.0 111.924 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -53.52 -44.2 67.45 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -75.32 141.67 43.35 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 122.296 -0.532 . . . . 0.0 109.977 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.851 -179.78 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.593 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 120.528 0.204 . . . . 0.0 110.798 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 18.4 mt 59.96 120.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.668 0.747 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -173.2 172.18 3.91 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.721 0.772 . . . . 0.0 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -57.53 -51.39 69.64 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 122.079 0.942 . . . . 0.0 109.448 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.54 ' N ' HD13 ' C' ' 663' ' ' LEU . 12.7 t70 -72.66 -16.64 61.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.759 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 tmtt? -81.08 -46.36 15.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.262 0.553 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -62.18 -46.34 89.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.241 0.543 . . . . 0.0 110.878 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.39 -22.09 66.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.982 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.7 -32.92 73.07 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.975 -0.453 . . . . 0.0 111.434 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.3 -34.16 77.5 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.194 0.521 . . . . 0.0 111.864 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.86 -26.77 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.983 0.421 . . . . 0.0 111.043 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -77.14 -31.75 55.85 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.942 0.401 . . . . 0.0 111.604 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.4 m0 -55.24 -42.65 73.71 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.542 0.687 . . . . 0.0 110.357 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 7.4 t80 55.49 34.58 23.34 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.218 0.532 . . . . 0.0 111.484 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -148.83 -73.7 0.18 Allowed 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.65 -0.656 . . . . 0.0 112.032 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.669 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -37.15 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.489 0.661 . . . . 0.0 111.599 -178.708 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -51.63 -33.54 33.8 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.91 -0.494 . . . . 0.0 111.383 -178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -57.29 -49.36 76.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.625 0.726 . . . . 0.0 109.64 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.521 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -64.56 -42.15 95.86 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.087 0.47 . . . . 0.0 110.062 179.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 32.2 mt -66.15 -35.64 81.01 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -99.56 -19.58 16.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -176.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -88.15 -18.17 29.35 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.428 -0.795 . . . . 0.0 112.281 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.522 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.0 pt -63.16 -37.58 79.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 O-C-N 121.945 -0.472 . . . . 0.0 111.786 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -57.18 -47.41 81.3 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.294 0.568 . . . . 0.0 110.044 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.494 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.0 mp -65.96 -32.17 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -61.13 -32.43 72.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.722 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 13.3 mm -61.97 -48.75 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 121.171 0.51 . . . . 0.0 110.158 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.96 -41.1 91.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 90.3 mt -59.91 -37.56 72.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.469 HG23 ' O ' ' C' ' 685' ' ' PHE . 42.6 t -54.7 -41.66 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.42 -42.07 74.0 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.91 -38.23 88.16 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.812 0.815 . . . . 0.0 109.302 177.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.37 -45.99 89.9 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.097 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.674 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -68.1 -41.09 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.662 179.804 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.541 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -32.48 78.83 Favored Glycine 0 CA--C 1.54 1.619 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.588 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.7 tt -55.0 -37.34 66.47 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.816 0.817 . . . . 0.0 110.742 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -55.49 -28.37 54.19 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.541 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.4 tt -58.36 -35.72 55.14 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.267 -0.896 . . . . 0.0 111.603 -175.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.588 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.8 p -54.26 -30.32 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 O-C-N 121.411 -0.806 . . . . 0.0 109.852 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -57.0 -31.83 65.49 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.525 -0.734 . . . . 0.0 110.52 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.22 95.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.243 1.021 . . . . 0.0 108.603 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.2 -38.74 78.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.926 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 tp -65.7 -40.04 91.88 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.183 0.593 . . . . 0.0 110.393 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -62.93 -31.99 73.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.044 0.45 . . . . 0.0 110.27 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.439 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.5 OUTLIER -63.22 -46.8 85.27 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 122.412 1.101 . . . . 0.0 108.428 177.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.514 HG13 HD13 ' C' ' 748' ' ' LEU . 84.6 t -63.12 -45.95 97.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.495 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -63.37 -36.58 84.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.128 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 15.2 ttp85 -60.24 -50.04 75.24 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 121.482 -0.761 . . . . 0.0 111.37 -176.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.522 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -77.67 -43.08 29.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -178.183 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.84 -44.73 92.31 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -175.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . 0.455 ' HB2' ' HB3' ' B' ' 758' ' ' ASP . 6.5 pt20 -103.92 -23.9 13.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.31 -177.3 16.44 Favored Glycine 0 CA--C 1.538 1.477 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -138.73 -43.66 0.48 Allowed 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.534 -0.98 . . . . 0.0 112.229 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.407 ' O ' ' C ' ' C' ' 714' ' ' PRO . 82.6 p -62.71 147.6 92.82 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 117.704 -1.141 . . . . 0.0 107.924 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' C' ' 713' ' ' SER . 44.8 Cg_exo -28.44 94.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.505 2.172 0 C-N-CA 122.962 2.442 . . . . 0.0 112.212 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.66 HD22 ' CG ' ' B' ' 758' ' ' ASP . 5.3 mp -69.84 -9.71 55.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.204 -1.362 . . . . 0.0 114.466 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 122.29 1.043 . . . . 0.0 112.386 -178.847 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 122.133 0.968 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 24.7 tpt85 -59.38 -26.99 65.58 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.898 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -34.51 70.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 111.955 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.618 ' CZ ' HD11 ' B' ' 774' ' ' LEU . 32.8 mtm105 -67.57 -27.84 67.28 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.97 -37.54 74.4 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.736 -0.603 . . . . 0.0 109.647 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.47 -43.2 67.04 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 121.502 0.668 . . . . 0.0 109.615 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -58.74 -38.12 77.7 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 121.895 -0.503 . . . . 0.0 110.914 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -56.75 -20.0 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . 0.417 ' HA ' HD22 ' B' ' 785' ' ' LEU . 70.8 mtp180 -59.57 -25.07 64.26 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.589 -0.694 . . . . 0.0 109.494 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.522 HD11 HG12 ' C' ' 708' ' ' VAL . 7.7 mt -55.92 -28.8 58.48 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 122.254 -0.279 . . . . 0.0 111.512 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . 0.575 HG11 HG11 ' B' ' 782' ' ' VAL . 85.2 t -55.43 -54.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.436 HD22 ' H ' ' C' ' 750' ' ' ASN . 2.5 m-80 -73.08 -26.91 61.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.331 1.062 . . . . 0.0 109.074 174.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.29 -20.9 38.15 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.054 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 47.8 m -58.74 -37.85 77.09 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.834 0.817 . . . . 0.0 109.379 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.53 -51.18 38.05 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.721 0.772 . . . . 0.0 109.994 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . 0.692 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.31 -34.58 78.0 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.414 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.0 tt -58.77 -45.45 89.77 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.768 -0.583 . . . . 0.0 110.785 -177.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 41.8 mm -69.88 -33.35 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 110.278 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.38 -31.14 69.35 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -55.81 -47.01 77.9 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.064 -1.022 . . . . 0.0 109.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.29 -45.36 66.47 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.991 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 27.3 mt -66.35 -45.45 80.15 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -66.43 -48.78 68.93 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.865 -0.522 . . . . 0.0 112.102 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.1 t -64.94 -45.29 86.4 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 110.759 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.449 ' O ' ' HG ' ' C' ' 774' ' ' LEU . 1.0 OUTLIER -68.34 -54.54 16.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.843 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.89 -47.48 5.54 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.124 -0.985 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' C' ' 766' ' ' PHE . 1.6 tt 72.84 129.91 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -178.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' C' ' 765' ' ' LEU . 32.9 t80 -9.05 123.53 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.902 1.281 . . . . 0.0 114.359 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . 0.435 ' O ' ' C ' ' C' ' 768' ' ' TYR . 1.3 m 48.94 91.26 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.57 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' C' ' 770' ' ' ARG . 41.3 m-85 3.87 -97.86 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.691 1.197 . . . . 0.0 113.609 -179.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 39.59 -76.96 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.925 0.784 . . . . 0.0 113.103 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . 0.575 ' N ' ' O ' ' C' ' 768' ' ' TYR . 32.1 mmt180 -55.3 -29.01 57.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.465 0.706 . . . . 0.0 110.528 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.22 -38.15 79.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.671 -0.643 . . . . 0.0 109.452 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -38.82 72.94 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -69.32 -34.51 74.78 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.978 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.529 HD13 ' O ' ' C' ' 774' ' ' LEU . 3.5 tm? -58.4 -42.61 87.52 Favored 'General case' 0 C--N 1.355 0.813 0 O-C-N 121.759 -0.588 . . . . 0.0 109.606 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 8.3 mp -58.63 -43.05 89.57 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.921 -0.487 . . . . 0.0 111.181 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 9.9 mt -73.0 -33.24 65.65 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.107 0.479 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.542 ' O ' HG12 ' C' ' 781' ' ' ILE . 0.1 OUTLIER -62.35 -37.84 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.7 -42.72 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 122.151 -0.343 . . . . 0.0 110.9 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.772 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.6 p -63.36 -42.12 98.88 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.229 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -31.71 71.94 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 122.051 -0.405 . . . . 0.0 111.861 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.593 HD12 ' HB3' ' A' ' 743' ' ' ASP . 21.3 mm -56.23 -39.73 61.39 Favored 'Isoleucine or valine' 0 C--N 1.347 0.486 0 O-C-N 121.762 -0.586 . . . . 0.0 111.346 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.772 HG22 ' O ' ' C' ' 779' ' ' THR . 21.6 m -52.73 -37.44 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.464 -177.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.36 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.684 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 120.762 0.315 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 175.32 129.78 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -171.65 177.81 3.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.923 0.868 . . . . 0.0 111.117 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.488 HD23 ' N ' ' A' ' 664' ' ' ASP . 5.1 tt -51.57 -51.1 58.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.721 0.772 . . . . 0.0 110.544 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . 0.488 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.3 t70 -64.9 -30.51 71.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.864 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -48.15 37.22 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.406 0.622 . . . . 0.0 110.815 -179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -62.81 -46.08 89.62 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.674 0.75 . . . . 0.0 110.33 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.77 -20.2 65.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.718 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 24.7 t -71.38 -32.07 68.04 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.156 0.503 . . . . 0.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.99 -34.62 73.57 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.897 0.379 . . . . 0.0 111.061 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -59.69 -16.44 26.75 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.842 -0.536 . . . . 0.0 111.313 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -82.63 -26.16 32.48 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.361 0.6 . . . . 0.0 110.732 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -60.31 -42.07 94.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.537 0.684 . . . . 0.0 110.299 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.5 t80 60.56 35.09 20.16 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.543 0.687 . . . . 0.0 111.267 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -156.09 -66.92 0.11 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.619 -0.675 . . . . 0.0 111.652 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -65.55 -37.37 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 O-C-N 121.891 -0.506 . . . . 0.0 111.342 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.48 -34.3 48.55 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.898 -0.501 . . . . 0.0 111.986 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -63.4 -50.53 69.47 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.326 0.584 . . . . 0.0 110.261 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.581 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.5 t90 -66.01 -44.12 85.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 122.167 0.984 . . . . 0.0 109.53 178.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -35.77 77.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.949 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -101.25 -50.53 3.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -59.9 -10.35 3.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.545 -0.722 . . . . 0.0 112.645 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.766 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.0 pp -60.71 -36.33 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 121.657 -0.652 . . . . 0.0 110.368 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.766 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.9 ttt-85 -54.63 -47.27 73.68 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.998 0.427 . . . . 0.0 110.403 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -69.38 -35.99 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.3 OUTLIER -59.96 -30.51 69.15 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.122 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.99 HD12 HG21 ' C' ' 686' ' ' ILE . 12.3 mm -60.58 -50.04 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.374 0.607 . . . . 0.0 109.629 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 79.2 mt -60.84 -39.02 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.1 -36.97 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.049 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.7 t -54.17 -40.04 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.237 -0.914 . . . . 0.0 108.554 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.43 -39.2 92.59 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -64.72 -38.21 90.22 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.666 0.746 . . . . 0.0 109.587 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -46.18 89.05 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.502 -178.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -40.29 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.257 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.63 -28.42 67.8 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -61.98 -37.54 85.16 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.488 1.137 . . . . 0.0 109.035 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 29.7 mmt180 -55.73 -27.64 51.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.054 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 mm -58.19 -36.29 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 121.108 -0.995 . . . . 0.0 108.681 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.759 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -61.95 -30.29 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 O-C-N 121.534 -0.729 . . . . 0.0 110.572 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 6.4 m-85 -55.38 -29.07 57.76 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.865 -0.522 . . . . 0.0 110.54 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.14 -36.97 71.34 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.759 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.7 m -59.36 -36.2 62.62 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 CA-C-O 121.727 0.775 . . . . 0.0 108.967 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -60.89 -38.92 87.34 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.823 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 54.7 m -63.07 -38.86 92.89 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.762 0.792 . . . . 0.0 109.695 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.632 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.5 OUTLIER -61.4 -40.87 95.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 122.179 0.99 . . . . 0.0 109.312 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.798 HG22 HD12 ' A' ' 748' ' ' LEU . 95.8 t -68.56 -43.59 83.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.065 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -62.31 -41.79 98.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.409 ' HA ' HD21 ' C' ' 704' ' ' LEU . 15.1 ptp180 -66.05 -38.74 89.11 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 121.012 -1.055 . . . . 0.0 111.498 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.35 -43.96 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.955 0.883 . . . . 0.0 108.893 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -73.77 -15.73 61.19 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -87.97 -20.87 25.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.279 -0.888 . . . . 0.0 111.992 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.94 37.99 2.09 Favored Glycine 0 CA--C 1.54 1.638 0 O-C-N 121.6 -0.687 . . . . 0.0 113.094 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' NH1' ' C' ' 707' ' ' ARG . 0.6 OUTLIER 49.17 -133.49 1.5 Allowed 'General case' 0 CA--C 1.566 1.576 0 O-C-N 121.616 -0.932 . . . . 0.0 110.077 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.569 ' HA ' HG21 ' C' ' 708' ' ' VAL . 6.7 p -62.92 159.9 42.17 Favored Pre-proline 0 C--N 1.354 0.784 0 O-C-N 120.925 -1.11 . . . . 0.0 109.138 178.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . 0.421 ' HG3' HD12 ' C' ' 748' ' ' LEU . 35.7 Cg_exo -36.81 119.76 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.144 1.896 . . . . 0.0 112.877 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.449 HD23 ' N ' ' A' ' 716' ' ' SER . 0.1 OUTLIER -109.35 -20.54 12.89 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.449 ' N ' HD23 ' A' ' 715' ' ' LEU . 1.4 t . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 122.482 1.134 . . . . 0.0 110.589 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 CA--C 1.536 0.437 0 CA-C-O 121.698 0.761 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -58.04 -26.56 62.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.385 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.27 -37.01 74.13 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.695 -0.628 . . . . 0.0 112.133 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . 0.506 ' HD3' ' HB2' ' C' ' 762' ' ' SER . 0.1 OUTLIER -59.2 -46.39 88.54 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.777 -0.577 . . . . 0.0 112.363 -179.051 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . 0.791 ' HA ' HD11 ' C' ' 781' ' ' ILE . 1.4 p30 -59.46 -44.77 92.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.577 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -34.84 71.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.931 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 9.2 p -59.82 -42.52 93.68 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 122.113 -0.367 . . . . 0.0 111.438 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.878 HG22 HG21 ' C' ' 781' ' ' ILE . 21.9 mt -65.63 -46.64 88.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-O 116.771 -1.585 . . . . 0.0 113.66 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.489 ' HD2' ' HA ' ' C' ' 782' ' ' VAL . 0.1 OUTLIER -67.59 -5.0 13.42 Favored 'General case' 0 C--N 1.351 0.663 0 CA-C-N 122.204 2.275 . . . . 0.0 109.989 -178.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.798 HD12 HG22 ' A' ' 705' ' ' VAL . 2.8 tm? -54.9 -15.13 1.76 Allowed 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.542 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.304 1.3 t -53.1 -53.95 19.77 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 175.087 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.582 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.2 m-80 -72.39 -30.22 64.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 113.999 -1.455 . . . . 0.0 107.727 174.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.499 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.36 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 96.0 p -57.28 -36.87 71.57 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.3 -49.21 77.93 Favored 'General case' 0 C--N 1.346 0.457 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 176.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.0 73.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.735 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -59.21 -42.58 91.28 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.857 -0.527 . . . . 0.0 111.239 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 66.1 mt -61.61 -35.68 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.96 -30.61 69.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.199 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.511 ' HB3' HD13 ' B' ' 715' ' ' LEU . 7.1 m-20 -55.7 -49.22 73.59 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.566 -0.709 . . . . 0.0 109.58 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.75 -43.73 68.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.873 0.844 . . . . 0.0 110.388 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . 0.4 ' HA ' HD11 ' A' ' 763' ' ' LEU . 0.3 OUTLIER -59.74 -32.39 70.51 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.924 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -82.27 -31.14 30.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -177.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 35.8 t -66.46 -46.61 75.81 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.397 -0.814 . . . . 0.0 112.766 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -69.37 -55.05 11.52 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 121.661 -0.649 . . . . 0.0 112.406 -179.589 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 4.5 p -98.26 -49.13 4.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.685 0.755 . . . . 0.0 112.959 -177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.483 HD12 ' HG2' ' B' ' 739' ' ' GLU . 0.6 OUTLIER 83.76 -70.26 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.663 0.785 . . . . 0.0 110.636 -177.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -128.72 -58.25 1.17 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.792 -0.568 . . . . 0.0 111.051 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.4 m -92.2 132.15 36.87 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.081 0.467 . . . . 0.0 110.126 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CZ ' HD22 ' A' ' 771' ' ' LEU . 1.7 t80 -61.77 -13.0 19.67 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.121 -0.362 . . . . 0.0 111.413 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -37.56 87.99 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.926 0.87 . . . . 0.0 108.995 178.032 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -29.27 59.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.578 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 763' ' ' LEU . 24.4 tp -58.97 -39.44 81.73 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 41.5 mtp180 -66.93 -32.96 74.56 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.54 -45.68 74.99 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.679 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' HG23 ' A' ' 778' ' ' VAL . 5.7 tp -58.97 -42.29 89.58 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.136 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 775' ' ' LEU . 1.1 tt -63.38 -38.53 91.51 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.689 -0.632 . . . . 0.0 111.005 -177.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.75 -43.96 57.57 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 121.944 -0.473 . . . . 0.0 112.013 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . 0.415 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.6 pp -68.68 -37.45 77.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.048 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 774' ' ' LEU . 41.1 t -56.29 -46.17 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 121.791 -0.568 . . . . 0.0 109.706 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . 0.738 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.8 p -63.52 -46.01 88.01 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.835 -0.541 . . . . 0.0 112.067 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -31.79 72.37 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.471 ' HB ' HG21 ' B' ' 746' ' ' ILE . 56.4 mt -54.77 -36.41 36.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.583 -0.698 . . . . 0.0 110.55 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 779' ' ' THR . 13.1 m -54.2 -38.39 38.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 121.23 -0.919 . . . . 0.0 109.753 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.34 -49.22 78.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.626 0.726 . . . . 0.0 110.774 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 31.3 tp -70.01 -42.48 72.94 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.264 0.554 . . . . 0.0 111.92 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.538 HD22 ' ND2' ' B' ' 750' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 121.021 0.439 . . . . 0.0 111.703 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.452 ' C ' HD22 ' B' ' 661' ' ' LEU . 4.0 mp . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.57 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.0 mm? 61.77 115.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.524 0.678 . . . . 0.0 110.327 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -179.72 170.99 1.23 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.467 HD11 ' HB2' ' C' ' 660' ' ' LEU . 32.8 tp -64.22 -40.75 96.7 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 121.473 0.654 . . . . 0.0 110.498 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.13 -24.15 67.76 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.379 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -81.26 -43.21 19.53 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -62.02 -46.79 87.64 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 122.006 0.908 . . . . 0.0 110.607 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.22 65.45 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.618 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 7.1 t -72.31 -29.22 63.65 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.819 0.342 . . . . 0.0 111.389 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.562 HD12 HG23 ' B' ' 675' ' ' ILE . 3.8 mm? -59.91 -32.73 71.03 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 122.185 -0.322 . . . . 0.0 111.179 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -59.66 -20.38 55.76 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.769 -0.582 . . . . 0.0 111.197 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -88.0 -20.41 25.87 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.169 0.509 . . . . 0.0 111.341 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -72.55 -46.7 53.18 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.099 0.476 . . . . 0.0 111.127 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 67.7 t80 58.66 19.86 7.19 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.379 0.609 . . . . 0.0 111.314 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -130.53 -67.72 0.72 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 121.378 -0.826 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.562 HG23 HD12 ' B' ' 669' ' ' LEU . 6.4 tp -68.27 -37.11 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.891 0.377 . . . . 0.0 110.92 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.15 -33.92 42.42 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.232 -0.293 . . . . 0.0 111.775 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -63.79 -50.35 69.35 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 109.883 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.652 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.97 -43.08 88.94 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 121.751 0.786 . . . . 0.0 109.754 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -35.75 82.1 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 8.9 t90 -103.93 -26.68 12.56 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -82.24 -10.48 59.11 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.513 -0.742 . . . . 0.0 111.761 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.652 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -60.85 -36.33 70.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.824 -0.548 . . . . 0.0 110.793 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.5 ttt-85 -53.32 -47.39 69.33 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.925 0.393 . . . . 0.0 110.4 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.461 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -66.7 -35.58 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.528 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.03 -29.46 68.52 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.18 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.696 HD12 HG21 ' A' ' 686' ' ' ILE . 17.6 mm -60.79 -48.28 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.211 0.529 . . . . 0.0 110.277 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.44 -43.17 94.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 89.4 mt -58.85 -37.71 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 685' ' ' PHE . 46.6 t -62.2 -48.77 86.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.5 -27.1 11.12 Favored Glycine 0 CA--C 1.54 1.613 0 O-C-N 121.772 -0.58 . . . . 0.0 111.896 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.0 m -60.61 -39.68 89.07 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.494 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.62 -32.7 70.66 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.235 -0.916 . . . . 0.0 111.643 -177.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.494 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.87 -46.96 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.45 -27.39 67.78 Favored Glycine 0 CA--C 1.542 1.737 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 178.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -37.16 67.37 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.758 0.789 . . . . 0.0 110.458 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 15.9 mmt180 -55.18 -27.99 49.78 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.726 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.29 -36.44 58.1 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 O-C-N 120.792 -1.193 . . . . 0.0 109.465 -177.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.0 p -66.99 -30.25 48.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.477 -0.764 . . . . 0.0 110.169 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.6 m-85 -55.88 -30.58 61.77 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.648 -0.657 . . . . 0.0 109.652 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.57 76.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -41.98 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 176.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.08 -37.87 72.51 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.445 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 29.2 m -62.83 -37.0 85.04 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.289 0.566 . . . . 0.0 110.38 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -45.26 93.29 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 122.322 1.058 . . . . 0.0 109.137 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.8 -43.34 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.995 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.36 -36.42 82.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.568 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -63.58 -49.56 72.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 122.404 1.097 . . . . 0.0 110.764 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD21 ' B' ' 748' ' ' LEU . 1.5 t -77.16 -44.9 30.81 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 114.79 -1.095 . . . . 0.0 113.645 -177.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.25 -45.94 92.43 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.639 ' O ' HD12 ' B' ' 715' ' ' LEU . 5.1 pt20 -105.77 -24.69 12.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.415 1.102 . . . . 0.0 113.644 178.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 129.63 136.34 4.05 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . 0.632 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.8 p90 -73.71 -61.77 1.72 Allowed 'General case' 0 N--CA 1.477 0.913 0 O-C-N 122.002 -0.705 . . . . 0.0 112.072 -178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 54.9 p -66.35 159.36 73.0 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.632 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.51 ' HB3' HD23 ' A' ' 748' ' ' LEU . 41.7 Cg_exo -32.5 131.78 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.31 2.007 . . . . 0.0 112.825 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.639 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.6 tt -93.74 -20.42 20.15 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -176.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 715' ' ' LEU . 2.8 t . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 122.17 0.986 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . 0.483 ' HG2' HD12 ' A' ' 765' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 18.4 tpt85 -65.94 -26.98 67.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.575 0.703 . . . . 0.0 111.275 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -60.83 -6.7 1.9 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -55.73 -39.63 71.39 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.517 -0.739 . . . . 0.0 111.195 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -58.02 -39.69 78.97 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.655 -0.653 . . . . 0.0 109.74 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -68.01 -38.85 83.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . 0.458 ' O ' HD23 ' B' ' 748' ' ' LEU . 1.3 p -59.7 -44.68 93.57 Favored 'General case' 0 N--CA 1.462 0.175 0 O-C-N 121.963 -0.461 . . . . 0.0 110.564 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.51 HD11 HG22 ' A' ' 778' ' ' VAL . 1.2 mp -55.17 -19.45 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.418 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.513 ' HG3' HD11 ' A' ' 785' ' ' LEU . 1.3 ttt85 -59.89 -26.63 66.04 Favored 'General case' 0 C--N 1.346 0.428 0 O-C-N 121.594 -0.691 . . . . 0.0 109.437 178.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.664 HD21 HG11 ' B' ' 708' ' ' VAL . 3.2 mm? -55.49 -20.4 12.7 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . 0.414 HG23 ' O ' ' B' ' 746' ' ' ILE . 65.2 t -57.43 -54.22 33.84 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 176.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.538 ' ND2' HD22 ' A' ' 785' ' ' LEU . 4.4 m-80 -72.94 -18.0 61.43 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.211 174.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.06 -20.68 35.56 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.915 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 23.1 p -58.76 -38.05 77.6 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.031 0.916 . . . . 0.0 109.685 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.91 -49.98 58.83 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.243 0.544 . . . . 0.0 110.029 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.52 78.61 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.98 -45.53 88.64 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.582 -0.699 . . . . 0.0 111.604 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 55.9 mt -67.01 -38.59 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 121.835 0.826 . . . . 0.0 109.484 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.01 67.96 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.587 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -55.15 -49.35 72.03 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.734 -1.229 . . . . 0.0 110.05 -178.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.25 -46.36 61.18 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.18 -46.83 63.81 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -63.85 -37.82 88.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.37 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 84.5 p -70.44 -45.17 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.52 0.676 . . . . 0.0 110.957 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.678 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.7 OUTLIER -61.92 -53.7 52.13 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.926 0.714 . . . . 0.0 112.926 -178.517 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.6 p -98.5 -11.82 21.89 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -177.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.41 -154.62 0.34 Allowed 'General case' 0 CA--C 1.552 1.023 0 O-C-N 121.206 -0.934 . . . . 0.0 108.54 -177.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -48.93 -72.61 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.36 -0.837 . . . . 0.0 111.529 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 87.6 p -80.34 177.2 9.13 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.707 -0.621 . . . . 0.0 111.334 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.42 -31.98 13.13 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.978 -0.451 . . . . 0.0 110.722 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -53.89 -35.18 61.32 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.522 0.677 . . . . 0.0 109.854 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -29.57 60.33 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.66 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -59.44 -35.45 74.04 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 121.934 -0.479 . . . . 0.0 110.103 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -39.24 90.63 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -69.18 -45.18 70.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.337 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.678 HD13 ' O ' ' B' ' 763' ' ' LEU . 1.0 OUTLIER -63.05 -37.9 89.04 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.958 0.885 . . . . 0.0 110.564 179.721 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.537 HD13 ' O ' ' B' ' 775' ' ' LEU . 3.5 tm? -58.75 -36.66 74.72 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.381 0.61 . . . . 0.0 110.539 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.27 -35.61 73.86 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.59 -0.694 . . . . 0.0 112.152 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 21.7 pt -70.29 -37.09 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 O-C-N 121.688 -0.632 . . . . 0.0 111.325 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.513 HG12 HG12 ' C' ' 746' ' ' ILE . 3.4 m -61.9 -39.48 83.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 121.132 -0.98 . . . . 0.0 109.857 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 20.4 p -63.69 -47.32 81.66 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.929 -0.482 . . . . 0.0 112.2 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -33.25 74.15 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.405 -0.809 . . . . 0.0 111.269 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 71.0 mt -66.12 -44.57 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.8 -0.563 . . . . 0.0 111.834 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.603 HG11 HG11 ' C' ' 749' ' ' VAL . 24.8 m -59.3 -38.1 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.471 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -57.41 -44.25 84.43 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.798 0.809 . . . . 0.0 109.82 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 25.6 tp -69.98 -43.46 71.44 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.871 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' C' ' 750' ' ' ASN . 8.2 tp -65.03 -25.23 67.75 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.964 -0.46 . . . . 0.0 111.15 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -36.17 -47.96 1.1 Allowed Glycine 0 CA--C 1.536 1.363 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.75 97.44 8.08 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.686 -179.076 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.5 ' O ' HD12 ' C' ' 660' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 121.576 0.703 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.32 160.28 15.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.093 0.473 . . . . 0.0 110.818 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 172.81 175.56 0.1 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.29 0.567 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.699 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -58.07 -45.95 86.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.85 0.834 . . . . 0.0 109.622 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.654 ' N ' HD13 ' C' ' 663' ' ' LEU . 10.0 t70 -73.3 -22.7 60.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.149 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -46.51 14.58 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.1 0.476 . . . . 0.0 111.145 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -58.8 -46.15 88.26 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.406 0.622 . . . . 0.0 109.602 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.75 -21.04 65.29 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.971 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.1 t -64.86 -35.12 80.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.987 0.423 . . . . 0.0 111.523 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.68 -36.28 76.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.132 0.491 . . . . 0.0 110.98 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -59.55 -22.15 61.29 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.3 0.571 . . . . 0.0 110.768 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -75.93 -29.26 58.29 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.457 0.646 . . . . 0.0 110.736 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -61.52 -41.66 97.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.749 0.785 . . . . 0.0 109.892 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 5.7 t80 58.87 36.03 24.46 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.027 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -160.98 -68.08 0.06 Allowed 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.571 -0.706 . . . . 0.0 112.291 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.635 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -62.91 -37.22 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-O 121.472 0.653 . . . . 0.0 111.415 -178.689 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -52.41 -33.67 44.81 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 122.014 -0.429 . . . . 0.0 111.444 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -56.83 -49.25 75.98 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.63 0.729 . . . . 0.0 109.745 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.559 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.2 t90 -65.14 -40.62 94.67 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.908 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.69 -35.89 82.07 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -92.86 -48.39 6.57 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -60.34 -21.16 61.74 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.902 -0.499 . . . . 0.0 112.086 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.1 pp -60.48 -36.5 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 O-C-N 121.713 -0.617 . . . . 0.0 110.547 179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -57.65 -47.14 83.09 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.244 0.545 . . . . 0.0 110.257 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.471 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -70.95 -33.25 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 121.67 0.747 . . . . 0.0 109.067 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.452 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.62 -33.99 72.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.037 -179.309 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.99 HG21 HD12 ' A' ' 686' ' ' ILE . 13.0 mm -60.65 -43.48 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.45 0.643 . . . . 0.0 109.498 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -66.01 -41.65 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.25 -38.0 72.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.452 HG23 ' O ' ' C' ' 685' ' ' PHE . 69.3 t -54.99 -40.42 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.08 -37.82 87.27 Favored Glycine 0 CA--C 1.531 1.058 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -67.29 -37.72 83.86 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.063 0.935 . . . . 0.0 109.465 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.24 -44.55 92.35 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.024 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -62.68 -42.05 94.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 121.242 0.544 . . . . 0.0 109.778 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.62 -33.08 80.65 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.507 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.8 tt -60.82 -37.93 83.68 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.971 0.891 . . . . 0.0 109.839 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -56.09 -28.3 57.14 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.6 tt -58.44 -36.02 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.258 -0.901 . . . . 0.0 111.206 -175.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.507 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.5 p -54.43 -30.18 21.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 121.425 -0.797 . . . . 0.0 110.219 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -56.39 -31.3 63.72 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.822 -0.549 . . . . 0.0 110.293 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.65 82.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -68.72 -42.52 83.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.82 -38.14 84.4 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.496 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.0 m -66.76 -37.12 83.99 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.424 0.631 . . . . 0.0 110.088 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -63.73 -42.32 97.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.954 0.883 . . . . 0.0 108.821 178.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.659 HG13 HD21 ' C' ' 748' ' ' LEU . 41.0 t -65.08 -45.54 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 122.546 1.165 . . . . 0.0 108.716 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.85 -35.89 81.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.015 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.412 ' NH1' ' CZ ' ' A' ' 712' ' ' TYR . 0.0 OUTLIER -62.56 -49.58 74.72 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 121.685 -0.635 . . . . 0.0 111.336 -177.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.569 HG21 ' HA ' ' A' ' 713' ' ' SER . 3.0 p -77.47 -44.41 29.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.527 0.68 . . . . 0.0 112.331 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . 0.455 ' HB2' HD22 ' C' ' 748' ' ' LEU . 2.3 tmm_? -73.97 -33.11 63.74 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -101.56 -17.68 16.27 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 113.048 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.84 169.87 14.91 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -120.96 -48.56 2.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.217 -0.578 . . . . 0.0 110.962 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 25.7 p -106.69 157.98 33.86 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.615 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . 0.402 ' HG3' HD22 ' B' ' 748' ' ' LEU . 51.1 Cg_exo -38.14 96.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.803 0 C-N-CA 121.913 1.742 . . . . 0.0 111.912 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' C' ' 716' ' ' SER . 28.1 tp -73.41 -20.68 60.67 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . 0.469 ' C ' ' O ' ' C' ' 715' ' ' LEU . 3.2 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.079 0.943 . . . . 0.0 113.04 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.908 0.861 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 tpt85 -71.86 -26.85 62.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.563 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -38.92 84.91 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.24 0.543 . . . . 0.0 110.803 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.774 ' O ' HD12 ' C' ' 746' ' ' ILE . 28.0 mtm105 -62.5 -36.39 82.39 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.102 -0.374 . . . . 0.0 111.319 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -58.46 -39.93 81.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.484 . . . . 0.0 110.102 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.59 -49.33 41.49 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.137 0.494 . . . . 0.0 110.798 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -33.83 67.04 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.012 -0.43 . . . . 0.0 110.699 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.774 HD12 ' O ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -59.23 -24.43 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 O-C-N 121.469 -0.769 . . . . 0.0 109.095 178.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -59.37 -21.49 59.94 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.659 HD21 HG13 ' C' ' 705' ' ' VAL . 9.3 tp -55.62 -27.21 48.31 Favored 'General case' 0 C--N 1.348 0.519 0 O-C-N 122.128 -0.358 . . . . 0.0 110.748 178.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . 0.603 HG11 HG11 ' B' ' 782' ' ' VAL . 90.0 t -55.52 -54.08 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.443 ' HB2' HD23 ' B' ' 785' ' ' LEU . 4.3 m-80 -72.42 -25.8 61.62 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.33 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.59 -20.96 40.67 Favored Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.705 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.0 m -59.98 -37.95 81.11 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.752 -0.852 . . . . 0.0 109.386 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.6 tp -66.7 -51.2 58.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.418 0.628 . . . . 0.0 109.889 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.0 79.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.584 0.707 . . . . 0.0 111.365 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . 0.52 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.1 tt -59.4 -45.45 91.46 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 -178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.25 -35.04 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.64 0.733 . . . . 0.0 109.325 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.14 68.1 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.471 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -55.36 -46.61 76.46 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.069 -1.019 . . . . 0.0 109.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.69 -45.48 64.93 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.15 -44.0 73.19 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' C' ' 765' ' ' LEU . 10.3 mtm180 -61.39 -49.8 75.46 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . 0.506 ' HB2' ' HD3' ' A' ' 742' ' ' ARG . 1.7 p -66.15 -45.31 81.41 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.542 -0.724 . . . . 0.0 110.8 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.516 ' HA ' ' HG ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -59.72 -54.38 47.08 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 -178.408 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.86 -48.72 4.81 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' C' ' 761' ' ' ARG . 0.3 OUTLIER 85.97 -78.61 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -177.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -124.59 -86.89 0.63 Allowed 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.483 -0.761 . . . . 0.0 111.337 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 83.4 p -90.13 167.28 12.85 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.56 -0.713 . . . . 0.0 110.225 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.12 -16.18 63.6 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.949 0.404 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -71.12 -44.03 66.42 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -62.69 -30.65 71.55 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.335 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.431 ' C ' HD23 ' C' ' 771' ' ' LEU . 5.3 tt -60.54 -30.49 69.79 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.828 -0.545 . . . . 0.0 109.86 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -57.25 -38.44 73.83 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.167 -0.333 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.29 -39.2 93.9 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.739 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.722 HD22 HD12 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -67.39 -38.17 84.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 121.772 0.796 . . . . 0.0 109.872 178.498 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.724 ' O ' HG22 ' C' ' 778' ' ' VAL . 2.7 mm? -58.42 -36.27 73.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.81 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -70.56 -29.68 66.2 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.536 -0.727 . . . . 0.0 110.405 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . 0.722 HD12 HD22 ' C' ' 774' ' ' LEU . 48.2 mt -60.77 -39.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.346 0.415 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.153 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.724 HG22 ' O ' ' C' ' 775' ' ' LEU . 15.0 m -55.5 -43.83 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 119.067 0.849 . . . . 0.0 113.013 -175.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.534 ' O ' HG22 ' C' ' 782' ' ' VAL . 2.4 p -64.28 -48.21 76.56 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.107 -0.995 . . . . 0.0 111.615 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -29.13 68.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.878 HG21 HG22 ' A' ' 746' ' ' ILE . 0.1 OUTLIER -52.98 -36.55 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.6 -175.534 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.534 HG22 ' O ' ' C' ' 779' ' ' THR . 34.5 m -53.41 -37.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 119.11 -1.036 . . . . 0.0 112.092 -177.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.675 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.732 ' N ' HD23 ' C' ' 663' ' ' LEU . 6.8 tp . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 48.2 mt 56.82 90.08 0.04 OUTLIER 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.994 0.902 . . . . 0.0 110.267 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -161.7 -177.34 5.82 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.519 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.486 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.5 OUTLIER -52.31 -40.68 62.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.201 0.525 . . . . 0.0 110.512 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -36.02 65.92 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -178.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -43.54 56.95 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.387 0.613 . . . . 0.0 111.075 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -74.0 -45.83 47.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.406 -179.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.52 -35.86 82.13 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.137 0.494 . . . . 0.0 111.337 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -32.79 68.48 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.319 0.58 . . . . 0.0 110.886 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -24.1 67.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.828 0.347 . . . . 0.0 111.487 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -67.95 -19.57 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.003 -0.436 . . . . 0.0 111.688 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -80.88 -17.81 49.36 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.046 0.45 . . . . 0.0 111.508 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.72 -47.98 82.8 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.2 48.01 3.87 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 112.181 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.81 -71.48 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.651 -0.655 . . . . 0.0 112.235 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.657 HG13 HD23 ' A' ' 679' ' ' LEU . 7.2 tp -66.83 -36.81 78.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 O-C-N 121.804 -0.56 . . . . 0.0 112.054 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.7 m -51.75 -33.21 33.97 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.922 -0.486 . . . . 0.0 112.037 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.38 -49.55 77.37 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.564 -0.71 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -65.78 -44.8 84.7 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.545 0.688 . . . . 0.0 110.583 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.657 HD23 HG13 ' A' ' 675' ' ' ILE . 4.5 mm? -66.64 -37.43 84.81 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -89.91 -1.93 58.08 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -119.96 0.18 10.74 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.431 0.634 . . . . 0.0 110.619 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 685' ' ' PHE . 2.4 tp -61.66 -36.36 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-O 122.115 0.96 . . . . 0.0 110.112 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -59.39 -44.89 92.72 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.78 -33.66 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -59.66 -33.48 71.6 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.804 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.995 HG21 HD12 ' B' ' 686' ' ' ILE . 8.4 mm -60.69 -42.42 91.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.166 0.508 . . . . 0.0 109.9 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -71.82 -39.56 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.4 mt -61.94 -40.69 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.971 -0.455 . . . . 0.0 110.6 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 685' ' ' PHE . 63.0 t -54.49 -39.46 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.14 -36.54 82.56 Favored Glycine 0 CA--C 1.537 1.456 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.8 m -65.02 -38.16 89.99 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.816 0.817 . . . . 0.0 109.455 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.05 -46.39 88.36 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.704 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.787 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -68.48 -39.89 81.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.596 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.92 -20.74 54.1 Favored Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.219 -0.925 . . . . 0.0 111.014 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -36.68 82.47 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 122.128 0.965 . . . . 0.0 110.151 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 24.9 mmt180 -56.3 -30.18 62.18 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 1.4 pp -60.5 -36.64 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.542 -1.349 . . . . 0.0 108.893 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.81 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.3 t -67.16 -30.24 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 CA-C-N 115.357 -0.838 . . . . 0.0 108.933 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.2 OUTLIER -55.64 -27.92 52.45 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 122.871 0.468 . . . . 0.0 110.343 178.6 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.44 -36.97 69.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.81 HG22 ' O ' ' A' ' 698' ' ' VAL . 11.4 m -59.1 -35.69 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -42.6 91.35 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . 0.434 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 7.2 m -66.13 -41.16 90.87 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.795 0.807 . . . . 0.0 109.734 179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -40.84 94.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.788 HG23 HD12 ' A' ' 748' ' ' LEU . 0.4 OUTLIER -69.26 -39.61 79.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.448 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 710' ' ' GLN . 1.1 m-80 -62.3 -36.93 83.64 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.102 0.561 . . . . 0.0 111.493 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 9.0 ttm180 -62.59 -49.47 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.703 0.763 . . . . 0.0 110.252 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.04 -42.09 31.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.823 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -58.69 -41.37 86.09 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -174.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 706' ' ' ASN . 4.9 pt20 -101.97 -21.87 14.41 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -176.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 164.82 -128.11 1.74 Allowed Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.681 -0.637 . . . . 0.0 112.459 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 712' ' ' TYR . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 707' ' ' ARG . 0.1 OUTLIER -171.85 -116.84 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -178.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 713' ' ' SER . . . . . 0.436 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 7.3 m -62.83 159.4 45.36 Favored Pre-proline 0 C--N 1.352 0.687 0 O-C-N 120.641 -1.287 . . . . 0.0 109.083 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_exo -42.88 101.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.358 1.372 . . . . 0.0 111.699 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 715' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 716' ' ' SER . 0.2 OUTLIER -104.39 -20.79 13.62 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.362 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 716' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 121.997 0.903 . . . . 0.0 111.671 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.98 0.895 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -26.43 62.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.13 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.5 -9.94 0.57 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.8 mtm-85 -64.95 -46.36 81.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.349 -0.845 . . . . 0.0 111.208 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -63.44 -44.69 93.79 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.486 0.66 . . . . 0.0 111.685 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -71.19 -36.86 72.08 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.711 -0.618 . . . . 0.0 110.56 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 89.9 p -64.47 -42.21 96.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.759 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 746' ' ' ILE . . . . . 0.558 HD13 ' CD1' ' C' ' 781' ' ' ILE . 0.8 OUTLIER -64.96 -46.95 90.08 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.872 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.188 -178.744 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 747' ' ' ARG . . . . . 0.442 ' CD ' ' HA ' ' C' ' 782' ' ' VAL 0.32 14.3 ttt180 -70.26 -0.02 7.23 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 116.153 -2.219 . . . . 0.0 111.699 -176.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 748' ' ' LEU . . . . . 0.788 HD12 HG23 ' A' ' 705' ' ' VAL . 2.8 tm? -57.22 -15.5 6.03 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 169.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 749' ' ' VAL . . . . . 0.548 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.308 1.6 t -52.96 -54.37 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 750' ' ' ASN . . . . . 0.548 ' ND2' HG12 ' A' ' 749' ' ' VAL . 1.6 m-80 -72.86 -26.19 61.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 122.611 1.196 . . . . 0.0 108.458 174.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 751' ' ' GLY . . . . . 0.672 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.64 -19.27 27.05 Favored Glycine 0 C--N 1.341 0.831 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.822 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 11.1 p -57.23 -37.29 72.06 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.65 -47.69 84.22 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.12 -35.36 78.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.963 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 755' ' ' LEU . . . . . 0.696 ' O ' HD22 ' A' ' 755' ' ' LEU . 0.6 OUTLIER -59.26 -45.07 92.18 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.668 -0.645 . . . . 0.0 110.908 -177.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.7 mt -61.65 -37.75 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.62 -33.87 73.27 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.087 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 758' ' ' ASP . . . . . 0.814 ' OD1' HD22 ' B' ' 715' ' ' LEU . 17.7 m-20 -55.98 -45.11 79.06 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.823 0.82 . . . . 0.0 109.715 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.11 -41.38 74.06 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.432 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.23 -33.94 76.4 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 28.1 mtt85 -73.65 -25.8 60.45 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 60.5 p -77.02 -45.52 26.94 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.624 -0.673 . . . . 0.0 111.217 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 763' ' ' LEU . . . . . 0.695 ' HA ' HD13 ' A' ' 774' ' ' LEU . 10.4 mp -68.39 -54.94 13.84 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.01 -49.3 4.56 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.547 0.689 . . . . 0.0 112.493 -178.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 765' ' ' LEU . . . . . 0.457 HD23 ' CD ' ' B' ' 739' ' ' GLU . 1.1 tm? 88.62 -72.56 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.184 0.993 . . . . 0.0 109.658 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -118.67 -67.09 1.01 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.773 -0.58 . . . . 0.0 111.157 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.81 148.15 24.73 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.32 0.581 . . . . 0.0 110.842 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -62.62 -23.62 67.15 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.993 0.425 . . . . 0.0 110.878 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.868 0.842 . . . . 0.0 109.628 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -63.57 -29.82 71.02 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.482 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.461 HD22 ' HB3' ' A' ' 763' ' ' LEU . 0.1 OUTLIER -59.77 -45.27 92.77 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -179.393 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.02 -39.51 90.03 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.617 0.722 . . . . 0.0 109.322 177.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -64.64 -39.58 93.94 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.7 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -59.51 -38.74 81.75 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-O 121.109 0.481 . . . . 0.0 111.32 -179.615 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mt -58.63 -36.99 74.95 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.786 -0.571 . . . . 0.0 111.837 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 776' ' ' LEU . . . . . 0.479 HD12 ' N ' ' A' ' 776' ' ' LEU . 6.9 mp -74.04 -44.91 52.64 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.925 -0.484 . . . . 0.0 111.954 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 7.5 pt -64.4 -37.31 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.552 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 778' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 774' ' ' LEU . 79.3 t -57.45 -46.74 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.521 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 37.4 p -63.84 -35.99 82.44 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.21 1.005 . . . . 0.0 110.546 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -45.46 74.28 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.349 -0.842 . . . . 0.0 112.9 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 781' ' ' ILE . . . . . 0.531 HG13 HG21 ' B' ' 746' ' ' ILE . 11.6 pt -69.64 -36.77 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.39 -38.32 79.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.561 0 O-C-N 121.438 -0.789 . . . . 0.0 109.392 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -60.89 -43.47 98.44 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-O 121.545 0.688 . . . . 0.0 109.794 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.63 -39.57 84.66 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.59 0.71 . . . . 0.0 110.44 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . 0.522 HD22 ' ND2' ' B' ' 750' ' ' ASN . 0.3 OUTLIER . . . . . 0 CA--C 1.537 0.451 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.58 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.486 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.571 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.1 mm? 61.82 116.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.649 0.738 . . . . 0.0 110.529 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 177.65 178.45 0.32 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.396 0.617 . . . . 0.0 109.988 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.551 ' CD1' HD13 ' C' ' 660' ' ' LEU . 14.8 tp -50.97 -56.35 12.85 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 122.349 1.071 . . . . 0.0 110.71 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -20.21 65.92 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.793 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -81.15 -44.59 17.66 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.329 0.585 . . . . 0.0 110.25 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -74.91 -46.38 36.3 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.512 0.672 . . . . 0.0 111.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.82 63.39 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.559 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 54.4 p -71.58 -31.19 66.68 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.884 -0.51 . . . . 0.0 111.142 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.451 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.9 mm? -59.7 -30.72 68.99 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.09 0.472 . . . . 0.0 110.682 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -59.76 -22.9 62.74 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.06 0.457 . . . . 0.0 111.048 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.92 -24.92 23.47 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.148 0.499 . . . . 0.0 111.453 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.93 -51.61 66.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.281 0.562 . . . . 0.0 111.255 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 57.53 37.59 27.7 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.876 0.846 . . . . 0.0 110.724 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -140.06 -80.5 0.28 Allowed 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.843 -0.535 . . . . 0.0 110.461 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tt -68.2 -35.78 72.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 121.657 -0.652 . . . . 0.0 111.156 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -50.53 -33.41 21.52 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 121.982 -0.449 . . . . 0.0 111.716 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.72 -49.95 75.43 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.6 OUTLIER -65.88 -41.58 91.41 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 121.895 0.855 . . . . 0.0 109.591 177.521 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.492 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -62.22 -35.98 80.55 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -177.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -106.85 -26.31 11.3 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -79.57 -11.83 59.87 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.483 -0.761 . . . . 0.0 111.898 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.6 pt -60.66 -36.2 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.919 -0.488 . . . . 0.0 110.322 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -52.88 -47.35 67.93 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.29 -0.256 . . . . 0.0 110.682 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.487 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.3 mp -69.66 -36.11 68.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.5 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.9 -29.39 68.32 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.967 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.995 HD12 HG21 ' A' ' 686' ' ' ILE . 14.4 mm -61.21 -45.72 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 O-C-N 121.79 -0.569 . . . . 0.0 109.614 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 64.7 mt -65.63 -42.5 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.86 -37.78 68.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 685' ' ' PHE . 49.9 t -59.85 -48.88 86.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.76 -27.33 12.69 Favored Glycine 0 CA--C 1.541 1.693 0 O-C-N 121.691 -0.631 . . . . 0.0 112.054 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.1 m -60.65 -42.3 96.7 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.33 -32.75 70.37 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.457 -0.777 . . . . 0.0 112.108 -177.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.86 -47.83 85.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 O-C-N 121.704 -0.622 . . . . 0.0 109.618 -178.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.433 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -62.36 -32.83 84.25 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.548 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.7 tt -53.91 -36.43 62.72 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.287 1.042 . . . . 0.0 110.031 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.748 ' HG3' HD11 ' A' ' 693' ' ' ILE . 25.8 mmt180 -55.02 -27.63 45.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 124.104 0.961 . . . . 0.0 112.505 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.33 -36.1 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 O-C-N 120.832 -1.168 . . . . 0.0 108.844 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.548 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.7 p -64.51 -30.81 51.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.422 -0.799 . . . . 0.0 109.967 177.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.9 m-85 -56.65 -31.01 63.97 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.833 -0.542 . . . . 0.0 109.681 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.93 -37.52 76.89 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -41.57 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 176.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.9 tp -58.39 -39.12 78.8 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.825 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 50.2 m -64.07 -36.62 84.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.436 0.636 . . . . 0.0 109.813 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.464 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.3 OUTLIER -62.23 -43.28 99.19 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.28 1.038 . . . . 0.0 109.136 178.22 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . 0.718 HG22 HD23 ' B' ' 748' ' ' LEU . 93.8 t -69.82 -45.47 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.717 179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . 0.485 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 7.6 m-20 -62.92 -39.64 95.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.404 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -48.59 60.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 0.0 111.401 -177.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.5 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.4 OUTLIER -76.66 -42.55 34.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -176.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.53 -45.24 94.57 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . 0.658 ' O ' HD11 ' B' ' 715' ' ' LEU . 5.5 pt20 -104.84 -24.54 12.87 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 144.5 160.18 8.39 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -100.79 -70.64 0.73 Allowed 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.731 -0.864 . . . . 0.0 112.795 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 713' ' ' SER . . . . . 0.411 ' O ' ' C ' ' B' ' 714' ' ' PRO . 1.6 m -63.24 159.46 48.62 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.717 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 714' ' ' PRO . . . . . 0.411 ' C ' ' O ' ' B' ' 713' ' ' SER . 3.7 Cg_exo -28.44 108.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 122.651 2.234 . . . . 0.0 112.614 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 715' ' ' LEU . . . . . 0.814 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.6 tt -75.94 -11.91 60.05 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 122.159 0.98 . . . . 0.0 111.942 -178.723 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 739' ' ' GLU . . . . . 0.457 ' CD ' HD23 ' A' ' 765' ' ' LEU . 31.3 tp10 . . . . . 0 N--CA 1.464 0.249 0 CA-C-O 121.798 0.809 . . . . 0.0 111.405 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -30.16 65.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.266 -178.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.0 -8.39 2.29 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -35.66 80.77 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.538 -0.726 . . . . 0.0 111.13 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -58.74 -42.39 88.67 Favored 'General case' 0 C--N 1.344 0.33 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -71.43 -35.56 70.98 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.834 177.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.2 m -57.1 -37.73 72.35 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.065 -0.397 . . . . 0.0 110.227 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 746' ' ' ILE . . . . . 0.531 HG21 HG13 ' A' ' 781' ' ' ILE . 1.4 mp -55.68 -17.69 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.564 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 747' ' ' ARG . . . . . 0.496 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.2 OUTLIER -59.52 -29.66 68.04 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.149 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 748' ' ' LEU . . . . . 0.718 HD23 HG22 ' B' ' 705' ' ' VAL . 12.7 tp -55.7 -18.54 8.32 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.082 0.468 . . . . 0.0 110.05 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 42.5 t -55.69 -53.34 38.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.658 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 750' ' ' ASN . . . . . 0.522 ' ND2' HD22 ' A' ' 785' ' ' LEU . 4.2 m-80 -71.96 -18.87 61.96 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.795 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 751' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.16 -20.46 35.54 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.053 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 67.5 p -58.6 -38.14 77.34 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.849 -0.795 . . . . 0.0 109.408 179.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.84 -50.73 63.55 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.461 0.648 . . . . 0.0 109.62 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.84 -35.53 81.43 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.3 tt -59.84 -45.51 92.2 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.794 -0.567 . . . . 0.0 110.756 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.29 -37.78 80.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.652 0.739 . . . . 0.0 109.178 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.08 -30.31 68.6 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.342 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 758' ' ' ASP . . . . . 0.406 ' OD2' HD23 ' C' ' 715' ' ' LEU . 70.7 m-20 -55.58 -49.79 71.8 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.844 -1.16 . . . . 0.0 109.281 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.67 -45.89 60.58 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.42 0.628 . . . . 0.0 112.45 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 -46.72 65.37 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 8.9 ttm-85 -64.26 -49.94 69.91 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -177.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 3.0 m -62.27 -43.56 98.55 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.999 -0.438 . . . . 0.0 111.684 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 763' ' ' LEU . . . . . 0.589 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -60.89 -53.84 52.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 60.2 p -98.06 -49.24 4.83 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.396 0.617 . . . . 0.0 112.348 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 24.6 tp 69.15 102.92 0.06 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.867 0.842 . . . . 0.0 110.333 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 42.6 t80 64.6 -77.93 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.925 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 20.0 m -95.73 151.82 19.02 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.597 -0.689 . . . . 0.0 111.356 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.26 -30.88 43.28 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.864 0.364 . . . . 0.0 110.5 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -53.34 -40.44 64.9 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.92 0.867 . . . . 0.0 109.357 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.1 tpt85 -58.24 -29.49 65.79 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.578 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.95 -34.96 72.38 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -64.14 -35.03 79.46 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.98 -46.95 73.06 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 774' ' ' LEU . . . . . 0.628 ' HG ' HD11 ' B' ' 777' ' ' ILE . 1.5 tt -63.25 -37.98 89.37 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.953 0.882 . . . . 0.0 110.264 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 775' ' ' LEU . . . . . 0.566 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.3 OUTLIER -60.97 -37.06 81.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.836 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 776' ' ' LEU . . . . . 0.531 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.48 -44.86 63.95 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.931 -0.481 . . . . 0.0 111.688 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 777' ' ' ILE . . . . . 0.628 HD11 ' HG ' ' B' ' 774' ' ' LEU . 1.7 pp -64.5 -36.97 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.734 -0.604 . . . . 0.0 109.49 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 778' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' B' ' 781' ' ' ILE . 51.8 t -57.31 -46.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 O-C-N 121.678 -0.639 . . . . 0.0 111.028 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 779' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.8 t -63.5 -35.57 80.88 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.557 -0.714 . . . . 0.0 112.158 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -31.5 71.81 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.68 -0.638 . . . . 0.0 111.308 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 781' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' B' ' 778' ' ' VAL . 79.8 mt -60.42 -42.69 91.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.081 -0.387 . . . . 0.0 111.585 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 782' ' ' VAL . . . . . 0.601 HG22 ' O ' ' B' ' 779' ' ' THR . 6.7 m -54.93 -38.81 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.334 -0.854 . . . . 0.0 110.061 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.32 -45.56 92.68 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.596 0.713 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 17.5 tp -66.12 -43.97 85.6 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.293 0.568 . . . . 0.0 111.078 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 785' ' ' LEU . . . . . 0.511 HD23 ' ND2' ' C' ' 750' ' ' ASN . 4.2 tp -77.12 -16.47 59.16 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.074 0.464 . . . . 0.0 111.273 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.3 -48.11 15.91 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.88 106.99 19.38 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.524 -179.467 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.551 HD13 ' CD1' ' B' ' 663' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 121.496 0.665 . . . . 0.0 109.286 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.526 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.8 mp 60.68 120.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.621 0.725 . . . . 0.0 111.555 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.55 169.21 3.13 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.426 0.631 . . . . 0.0 110.059 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.732 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.3 OUTLIER -57.08 -52.07 66.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.763 0.792 . . . . 0.0 109.679 179.357 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.624 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -72.71 -17.15 61.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.853 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -81.07 -44.26 18.27 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.027 0.441 . . . . 0.0 111.189 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -63.95 -46.28 85.41 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.45 0.643 . . . . 0.0 110.284 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.48 -26.53 68.76 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.533 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -63.75 -37.97 89.37 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.047 0.451 . . . . 0.0 111.723 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.18 -34.78 74.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.869 0.366 . . . . 0.0 111.629 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -59.67 -21.96 61.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.036 0.446 . . . . 0.0 111.285 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -79.61 -24.54 41.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.173 0.511 . . . . 0.0 111.26 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -58.77 -37.63 76.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.507 0.67 . . . . 0.0 110.352 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 59.09 27.48 16.45 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.008 178.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.71 -68.81 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.548 -0.72 . . . . 0.0 112.227 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.703 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -58.05 -37.93 64.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.517 0.675 . . . . 0.0 111.083 -178.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.54 -33.84 47.36 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.958 -0.463 . . . . 0.0 111.149 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -62.95 -50.03 72.42 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.037 0.446 . . . . 0.0 110.343 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.701 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.69 -44.2 86.92 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.284 0.564 . . . . 0.0 109.801 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.559 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.55 -35.76 82.01 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.06 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -95.51 -33.52 12.4 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -75.36 -16.37 60.39 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.788 -0.57 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.701 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.0 pp -60.54 -36.77 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.877 -0.514 . . . . 0.0 110.304 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.556 ' N ' HD12 ' C' ' 682' ' ' ILE . 9.5 ttt-85 -57.04 -47.34 81.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.216 0.531 . . . . 0.0 110.005 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.427 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -66.81 -35.73 75.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.406 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.81 -32.03 70.26 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.867 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.942 HG21 HD12 ' A' ' 686' ' ' ILE . 9.6 mm -60.86 -49.51 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.327 0.584 . . . . 0.0 109.95 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -65.27 -36.94 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.8 -37.94 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.406 HG23 ' O ' ' C' ' 685' ' ' PHE . 73.5 t -55.73 -39.99 58.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.18 -40.32 91.44 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 9.8 m -63.26 -39.41 94.53 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 122.167 0.984 . . . . 0.0 109.817 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -46.15 89.2 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.318 -177.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.85 -42.12 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . 0.622 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.51 -32.28 77.4 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.66 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.3 tt -58.22 -38.41 76.74 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.997 0.903 . . . . 0.0 109.645 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -55.95 -28.13 55.6 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.622 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.8 tt -58.06 -36.35 56.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 120.924 -1.11 . . . . 0.0 111.141 -175.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.66 HG12 ' O ' ' C' ' 695' ' ' LEU . 13.9 p -54.86 -29.51 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 121.402 -0.812 . . . . 0.0 109.375 176.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.43 -31.58 64.06 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.171 -0.956 . . . . 0.0 109.619 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . 0.434 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.48 -43.01 97.41 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 52.7 t -68.33 -36.24 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.698 177.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.82 -37.03 82.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.366 0.667 . . . . 0.0 109.773 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.6 m -62.19 -36.45 81.95 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.219 0.533 . . . . 0.0 110.518 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -41.35 97.91 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 122.153 0.977 . . . . 0.0 108.708 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . 0.533 ' HA ' HD11 ' C' ' 748' ' ' LEU . 60.5 t -65.58 -44.53 93.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-O 122.176 0.988 . . . . 0.0 108.952 178.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.35 -35.88 80.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.333 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -49.69 75.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 121.685 -0.634 . . . . 0.0 110.532 -178.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -44.67 32.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.435 0.636 . . . . 0.0 111.766 -178.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -73.36 -39.85 64.84 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.377 -178.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -102.67 -18.89 15.0 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 102.31 171.11 27.08 Favored Glycine 0 CA--C 1.536 1.348 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 712' ' ' TYR . . . . . 0.464 ' O ' HD11 ' B' ' 704' ' ' LEU . 15.1 p90 -119.13 -54.29 2.22 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.681 -0.893 . . . . 0.0 112.297 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 713' ' ' SER . . . . . 0.5 ' HA ' HG21 ' B' ' 708' ' ' VAL . 87.6 p -94.44 159.42 33.84 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-O 118.752 -0.642 . . . . 0.0 110.423 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -39.55 103.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.668 1.579 . . . . 0.0 111.749 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 715' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' C' ' 716' ' ' SER . 27.7 tp -85.81 -19.89 30.0 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 716' ' ' SER . . . . . 0.479 ' C ' ' O ' ' C' ' 715' ' ' LEU . 35.5 t . . . . . 0 N--CA 1.5 2.052 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.58 0.705 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -61.7 -33.26 73.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.346 0.593 . . . . 0.0 111.088 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -58.32 -38.23 76.7 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.113 0.482 . . . . 0.0 110.95 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 742' ' ' ARG . . . . . 0.464 ' HD2' HD11 ' B' ' 774' ' ' LEU . 26.2 mtm105 -63.24 -42.67 99.23 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 122.175 -0.328 . . . . 0.0 111.153 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -58.03 -38.42 76.2 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.41 0.624 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -71.1 -42.54 69.17 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.375 0.607 . . . . 0.0 109.573 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.28 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.123 -0.361 . . . . 0.0 111.051 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 746' ' ' ILE . . . . . 0.416 HG21 ' HB ' ' B' ' 781' ' ' ILE . 1.5 mp -57.58 -21.0 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 120.039 -0.664 . . . . 0.0 109.717 178.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -59.67 -28.13 66.99 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.359 -0.838 . . . . 0.0 109.074 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 748' ' ' LEU . . . . . 0.591 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.2 tt -55.98 -24.49 39.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 53.8 t -55.59 -54.6 24.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 750' ' ' ASN . . . . . 0.511 ' ND2' HD23 ' B' ' 785' ' ' LEU . 4.3 m-80 -72.9 -26.76 61.54 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.094 0.95 . . . . 0.0 109.233 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.32 -20.83 38.12 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.241 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 74.7 m -60.51 -38.02 83.0 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.919 -0.754 . . . . 0.0 109.429 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.61 -50.1 54.12 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.352 0.596 . . . . 0.0 110.159 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.71 80.24 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -60.38 -45.46 93.46 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.311 0.577 . . . . 0.0 110.383 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 54.5 mt -65.62 -36.91 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.894 0.854 . . . . 0.0 108.717 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.22 -30.6 68.79 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.933 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -55.56 -46.01 77.22 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.571 -0.706 . . . . 0.0 110.244 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.25 -41.9 72.91 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.283 0.563 . . . . 0.0 110.987 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -33.34 75.5 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -81.95 -38.93 24.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -44.52 61.89 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.246 -0.909 . . . . 0.0 109.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 763' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' C' ' 771' ' ' LEU . 5.2 tt -64.23 -53.66 45.63 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.502 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 764' ' ' SER . . . . . 0.528 ' HB2' HD12 ' C' ' 771' ' ' LEU . 46.6 t -97.81 -49.24 4.89 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.529 -0.732 . . . . 0.0 112.496 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.17 98.53 0.07 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 122.036 0.922 . . . . 0.0 110.914 -178.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 62.9 t80 48.88 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.417 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 20.3 t -73.9 154.01 39.59 Favored 'General case' 0 C--N 1.346 0.418 0 O-C-N 121.325 -0.859 . . . . 0.0 110.598 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 768' ' ' TYR . . . . . 0.469 ' CE2' HD13 ' C' ' 771' ' ' LEU . 0.3 OUTLIER -76.24 -19.46 58.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.93 0.395 . . . . 0.0 110.761 179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -43.72 88.37 Favored 'General case' 0 C--N 1.345 0.375 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.5 mmt-85 -58.73 -30.77 67.72 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.487 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 771' ' ' LEU . . . . . 0.744 ' O ' HD23 ' C' ' 771' ' ' LEU . 4.4 tt -60.67 -32.6 71.79 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.08 0.467 . . . . 0.0 109.842 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.31 -37.78 70.39 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -63.98 -34.72 78.64 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 774' ' ' LEU . . . . . 0.472 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -58.64 -38.68 78.62 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-O 121.074 0.464 . . . . 0.0 110.355 179.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 775' ' ' LEU . . . . . 0.426 ' O ' HG22 ' C' ' 778' ' ' VAL . 4.1 mm? -59.24 -43.25 92.39 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.564 0.697 . . . . 0.0 110.623 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 50.3 mt -74.34 -34.7 63.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.603 0.716 . . . . 0.0 110.182 178.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.03 -43.15 95.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.523 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 778' ' ' VAL . . . . . 0.527 HG12 HG12 ' A' ' 746' ' ' ILE . 34.6 m -64.93 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.191 -179.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 779' ' ' THR . . . . . 0.773 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.2 OUTLIER -63.79 -48.11 78.21 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.843 -0.535 . . . . 0.0 111.784 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -31.41 71.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.143 0.497 . . . . 0.0 111.769 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 781' ' ' ILE . . . . . 0.558 ' CD1' HD13 ' A' ' 746' ' ' ILE . 21.2 mt -57.85 -36.88 57.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 782' ' ' VAL . . . . . 0.773 HG22 ' O ' ' C' ' 779' ' ' THR . 33.9 m -53.2 -37.77 28.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.518 0 CA-C-N 119.35 0.977 . . . . 0.0 110.94 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 . . . . . 0 CA--C 1.543 0.685 0 O-C-N 121.855 -0.528 . . . . 0.0 112.074 -179.84 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.616 ' N ' HD23 ' C' ' 663' ' ' LEU . 1.4 mt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 69.0 mt 57.97 116.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.981 0.896 . . . . 0.0 112.117 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -176.63 175.04 1.76 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.532 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.425 ' C ' HD23 ' A' ' 663' ' ' LEU . 10.3 tt -50.67 -39.87 52.17 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.504 0.668 . . . . 0.0 110.837 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -74.37 -36.07 63.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.51 0.671 . . . . 0.0 111.7 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -43.21 78.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 111.301 -179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -67.16 -46.27 74.5 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.498 0.666 . . . . 0.0 110.242 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.59 -38.0 83.4 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.469 0.652 . . . . 0.0 110.758 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.8 m -60.41 -33.82 73.05 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.347 0.594 . . . . 0.0 111.115 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.0 tp -61.28 -25.52 67.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.87 0.367 . . . . 0.0 111.605 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -59.84 -25.87 65.35 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.766 -0.584 . . . . 0.0 110.799 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -64.12 -27.28 68.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.204 0.526 . . . . 0.0 111.15 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -59.68 -52.51 65.2 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.766 0.793 . . . . 0.0 110.215 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 26.1 t80 64.12 24.72 13.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.116 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -143.5 -61.93 0.4 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.67 -0.644 . . . . 0.0 111.338 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.7 tp -67.58 -37.68 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.395 0.617 . . . . 0.0 110.574 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -52.95 -34.24 54.71 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -67.33 -50.14 61.23 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.218 0.533 . . . . 0.0 111.31 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.554 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.6 OUTLIER -66.2 -43.35 87.0 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.425 0.631 . . . . 0.0 109.823 179.027 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.414 HD23 HG13 ' A' ' 675' ' ' ILE . 2.3 mm? -66.37 -35.91 81.53 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -99.58 8.37 44.5 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -176.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -120.24 -10.89 9.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.514 -0.742 . . . . 0.0 112.088 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.554 HG23 ' O ' ' A' ' 678' ' ' TRP . 6.8 pt -61.6 -35.73 68.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 121.867 -0.521 . . . . 0.0 110.527 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -47.29 68.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.036 -0.415 . . . . 0.0 110.765 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.455 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -68.86 -35.96 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.534 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.7 OUTLIER -59.96 -28.12 67.39 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.427 179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.923 HD12 HG21 ' C' ' 686' ' ' ILE . 18.2 mm -60.79 -46.14 96.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.284 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 62.6 mt -64.67 -38.48 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.2 -37.19 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.3 t -54.55 -40.4 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.66 -39.37 85.94 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 177.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.3 m -66.66 -38.36 86.7 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.722 0.772 . . . . 0.0 109.413 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.39 -46.31 89.03 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.72 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.746 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.99 -40.56 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.439 -179.561 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.47 -24.2 61.37 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.26 -38.2 82.76 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.88 0.848 . . . . 0.0 109.632 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.6 mmt180 -55.5 -28.17 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.486 0.715 . . . . 0.0 112.243 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.15 -39.42 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -177.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.76 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.63 -30.49 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 O-C-N 121.609 -0.682 . . . . 0.0 109.704 176.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.43 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -55.95 -29.06 59.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.92 0.39 . . . . 0.0 110.445 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.04 71.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.76 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -59.56 -35.85 61.61 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.025 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.73 -39.45 77.33 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 58.1 m -62.72 -38.29 89.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.581 0.705 . . . . 0.0 109.794 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -45.72 93.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.31 1.052 . . . . 0.0 108.571 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.53 HG22 HD12 ' A' ' 748' ' ' LEU . 93.3 t -62.35 -45.27 99.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.12 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 3.2 m120 -62.68 -38.45 90.44 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.244 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.656 HH21 HG23 ' A' ' 708' ' ' VAL . 4.5 tmm_? -62.61 -45.94 90.57 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.805 -0.559 . . . . 0.0 111.0 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.656 HG23 HH21 ' A' ' 707' ' ' ARG . 1.2 t -76.19 -42.01 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-O 122.233 1.016 . . . . 0.0 109.033 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -70.56 -18.93 62.92 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 27.5 tt0 -86.72 -13.47 45.25 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.499 0.666 . . . . 0.0 111.876 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 97.09 46.61 2.38 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.1 t80 52.18 -127.73 2.41 Favored 'General case' 0 CA--C 1.564 1.5 0 O-C-N 122.0 -0.706 . . . . 0.0 109.8 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 66.2 m -62.25 130.9 93.41 Favored Pre-proline 0 C--N 1.347 0.49 0 O-C-N 120.987 -1.071 . . . . 0.0 109.378 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.507 ' CG ' HD21 ' C' ' 748' ' ' LEU . 71.9 Cg_exo -43.59 106.62 0.08 OUTLIER 'Trans proline' 0 N--CA 1.495 1.605 0 C-N-CA 121.111 1.207 . . . . 0.0 111.922 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -99.61 -5.4 29.09 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.44 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 3.8 t . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 122.507 1.146 . . . . 0.0 109.18 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 121.872 0.844 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -57.74 -26.09 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.634 0.73 . . . . 0.0 110.739 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -55.8 -22.78 26.34 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.665 ' O ' HD12 ' A' ' 746' ' ' ILE . 5.8 mtm105 -65.63 -46.62 78.56 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.663 -0.648 . . . . 0.0 112.472 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -44.62 91.52 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.75 -0.594 . . . . 0.0 110.827 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -40.15 72.48 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.125 -0.36 . . . . 0.0 111.331 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 61.9 p -65.5 -33.46 75.98 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 122.203 -0.311 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.4 OUTLIER -63.17 -46.45 95.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.28 179.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.944 ' HB3' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -62.09 -8.71 5.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.171 -1.412 . . . . 0.0 111.313 -177.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 705' ' ' VAL . 0.2 OUTLIER -55.73 -14.94 2.55 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.486 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.316 1.9 t -52.97 -54.59 16.06 Favored 'Isoleucine or valine' 0 C--N 1.35 0.595 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 176.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.518 HD22 ' H ' ' A' ' 750' ' ' ASN . 2.3 m-80 -73.36 -28.58 62.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.06 -1.427 . . . . 0.0 109.103 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.78 -19.9 30.57 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.035 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 78.6 p -57.93 -37.74 74.64 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 36.8 tp -62.1 -50.87 70.2 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.16 72.4 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.629 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.441 ' C ' HD23 ' A' ' 755' ' ' LEU . 9.9 tt -58.97 -44.05 91.48 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.62 -0.675 . . . . 0.0 110.768 -178.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.8 mt -61.56 -36.97 76.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.62 68.84 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.228 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.656 ' OD2' HD22 ' B' ' 715' ' ' LEU . 51.5 m-20 -55.58 -43.85 76.36 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.383 0.611 . . . . 0.0 109.805 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.46 -41.08 73.26 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 110.682 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.65 -33.54 76.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.711 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -77.42 -30.84 53.66 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 6.5 p -77.33 -45.25 26.73 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.359 -0.838 . . . . 0.0 110.342 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.462 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -68.12 -53.72 23.3 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -178.183 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 92.0 p -98.13 -49.15 4.84 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.538 -0.726 . . . . 0.0 112.69 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 17.4 tp 101.29 -87.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.318 1.447 . . . . 0.0 110.689 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -110.8 -70.68 0.8 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.468 -0.77 . . . . 0.0 110.976 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.4 t -87.25 158.74 19.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.201 0.524 . . . . 0.0 110.322 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -83.11 13.26 4.23 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.037 0.446 . . . . 0.0 111.529 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -98.93 -41.73 7.46 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.622 0.725 . . . . 0.0 109.321 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -56.04 -29.91 61.13 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.753 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.74 -31.02 69.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.051 -0.406 . . . . 0.0 111.244 -177.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ptt85 -57.49 -40.18 78.07 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.612 0.72 . . . . 0.0 109.637 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.39 -42.98 74.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.048 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.3 tt -60.57 -38.42 84.5 Favored 'General case' 0 C--N 1.349 0.56 0 CA-C-O 121.438 0.637 . . . . 0.0 110.459 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.57 -35.76 72.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.146 0.974 . . . . 0.0 109.328 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.95 -44.95 65.01 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.399 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.716 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -65.82 -37.3 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.91 -0.494 . . . . 0.0 111.056 -178.087 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.716 ' N ' HD13 ' A' ' 777' ' ' ILE . 17.4 m -60.81 -46.54 96.0 Favored 'Isoleucine or valine' 0 C--N 1.35 0.588 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.271 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.78 ' O ' HG22 ' A' ' 782' ' ' VAL . 7.2 m -64.22 -36.91 85.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-O 121.824 0.821 . . . . 0.0 109.674 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . 0.442 ' HD3' HD13 ' A' ' 784' ' ' LEU . 2.2 ttt85 -65.58 -30.35 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.944 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.74 HG21 ' CG2' ' B' ' 746' ' ' ILE . 3.5 tp -53.49 -36.57 27.92 Favored 'Isoleucine or valine' 0 C--N 1.348 0.529 0 O-C-N 121.887 -0.508 . . . . 0.0 111.28 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 779' ' ' THR . 16.7 m -55.09 -38.11 45.19 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 C-N-CA 119.354 -0.939 . . . . 0.0 110.271 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -64.91 -46.58 81.11 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.509 0.671 . . . . 0.0 110.756 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.442 HD13 ' HD3' ' A' ' 780' ' ' ARG . 7.2 mp -64.47 -40.9 96.56 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.527 0.679 . . . . 0.0 111.39 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.503 HD23 ' ND2' ' B' ' 750' ' ' ASN . 59.4 tp -87.22 -10.74 51.74 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 121.102 0.477 . . . . 0.0 111.746 -179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -76.43 -32.47 51.3 Favored Glycine 0 CA--C 1.534 1.239 0 O-C-N 121.853 -0.529 . . . . 0.0 111.943 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 152.15 45.89 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.649 0.737 . . . . 0.0 111.106 -179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.064 -0.97 . . . . 0.0 109.97 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.435 HD12 ' N ' ' B' ' 660' ' ' LEU . 7.0 mp . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.561 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.0 mm? 60.92 116.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.313 0.577 . . . . 0.0 110.506 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -173.72 161.98 3.98 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.347 0.594 . . . . 0.0 109.64 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.538 HD11 HD13 ' C' ' 660' ' ' LEU . 9.4 tt -55.41 -43.99 75.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.656 0.741 . . . . 0.0 110.31 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.18 -28.62 67.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.376 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.0 tptt -75.57 -48.9 20.36 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.045 0.45 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.416 ' CE2' HD22 ' C' ' 661' ' ' LEU . 83.7 m95 -58.55 -45.99 87.77 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.616 0.722 . . . . 0.0 110.39 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.36 -21.22 66.66 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.681 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 27.6 t -72.32 -26.82 62.09 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.987 0.422 . . . . 0.0 111.545 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.37 -39.16 92.26 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.964 -0.46 . . . . 0.0 111.602 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -59.73 -20.36 56.0 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.931 -0.481 . . . . 0.0 111.355 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -82.07 -24.43 35.26 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.292 0.568 . . . . 0.0 111.006 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -68.9 -47.27 66.22 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.511 0.672 . . . . 0.0 110.626 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 44.2 t80 58.28 32.17 21.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.68 0.752 . . . . 0.0 111.31 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -140.26 -70.83 0.38 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.815 -0.553 . . . . 0.0 110.662 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.15 -37.5 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 121.848 -0.532 . . . . 0.0 111.081 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -52.56 -35.46 53.81 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 24.7 m120 -62.83 -50.08 72.36 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.868 -0.52 . . . . 0.0 110.493 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.503 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.7 t90 -66.24 -43.77 85.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.982 0.896 . . . . 0.0 109.638 177.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.66 -35.72 78.75 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.127 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -94.79 -50.83 4.97 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -53.33 -18.2 2.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.802 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.9 pp -60.51 -36.65 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 O-C-N 121.759 -0.588 . . . . 0.0 110.544 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . 0.802 ' N ' HD12 ' B' ' 682' ' ' ILE . 14.1 ttt-85 -58.25 -47.46 83.49 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.908 -0.495 . . . . 0.0 110.93 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.477 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.04 -34.48 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -27.94 69.2 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.253 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.813 HD12 HG21 ' A' ' 686' ' ' ILE . 18.5 mm -60.7 -50.87 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.417 0.627 . . . . 0.0 110.213 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -63.68 -40.4 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.27 0.557 . . . . 0.0 109.524 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.52 -38.9 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.85 -48.12 90.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.51 -27.0 10.89 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.769 -0.582 . . . . 0.0 111.744 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 5.4 m -60.81 -45.27 95.09 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.619 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.26 -32.39 69.96 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.651 -0.656 . . . . 0.0 112.546 -176.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.619 ' H ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.88 -46.36 87.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 O-C-N 121.725 -0.609 . . . . 0.0 110.165 -178.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.98 -31.73 79.61 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 178.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.64 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.2 tt -57.66 -36.55 72.04 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.493 1.139 . . . . 0.0 110.389 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.746 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.5 mmt180 -55.59 -28.88 57.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -36.68 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.907 -1.121 . . . . 0.0 110.251 -176.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.64 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.36 -30.85 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.444 -0.785 . . . . 0.0 110.92 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -56.71 -31.42 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.857 -0.527 . . . . 0.0 110.404 -179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.4 80.37 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.51 -38.06 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -64.96 -37.68 88.47 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.157 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 59.6 p -64.06 -34.55 78.27 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.212 0.53 . . . . 0.0 110.743 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -43.12 94.73 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.129 0.966 . . . . 0.0 109.161 178.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' B' ' 748' ' ' LEU . 93.5 t -68.98 -44.92 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.15 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.54 -36.15 81.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -62.04 -50.03 73.63 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 122.071 0.939 . . . . 0.0 109.999 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.562 ' CG1' HD12 ' B' ' 748' ' ' LEU . 1.7 t -77.57 -44.07 29.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.921 -1.036 . . . . 0.0 113.239 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -57.79 -44.24 86.13 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 6.6 pt20 -103.79 -23.76 13.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 130.58 128.51 3.0 Favored Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -71.19 -60.55 2.17 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.75 152.28 90.59 Favored Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 121.152 -0.967 . . . . 0.0 110.58 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.461 ' HG3' HD23 ' A' ' 748' ' ' LEU . 69.4 Cg_exo -32.72 113.49 0.06 OUTLIER 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.563 2.176 . . . . 0.0 112.501 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.656 HD22 ' OD2' ' A' ' 758' ' ' ASP . 6.0 tt -77.3 -16.33 59.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 122.097 0.951 . . . . 0.0 112.126 -178.976 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 121.002 0.43 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -28.15 63.16 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.081 0.467 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.16 -7.12 3.66 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.692 HH11 HD11 ' A' ' 777' ' ' ILE . 8.2 ttp-105 -68.19 -40.25 82.28 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.806 -0.559 . . . . 0.0 111.623 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.11 -43.68 87.31 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.243 0.544 . . . . 0.0 109.715 -179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' B' ' 747' ' ' ARG . 0.0 OUTLIER -71.33 -39.33 71.45 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.188 178.085 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 52.6 p -56.94 -34.41 67.97 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 121.326 -0.858 . . . . 0.0 110.957 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.74 ' CG2' HG21 ' A' ' 781' ' ' ILE . 87.1 mt -52.88 -25.2 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.478 -0.773 . . . . 0.0 112.287 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 744' ' ' ARG . 0.0 OUTLIER -59.67 -28.48 67.31 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.783 1.629 . . . . 0.0 109.132 179.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.562 HD12 ' CG1' ' B' ' 708' ' ' VAL . 3.5 mt -55.9 -16.36 4.56 Favored 'General case' 0 C--N 1.353 0.741 0 O-C-N 121.75 -0.594 . . . . 0.0 110.696 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 31.8 t -56.54 -54.13 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 106.978 -1.489 . . . . 0.0 106.978 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.503 ' ND2' HD23 ' A' ' 785' ' ' LEU . 3.0 m-80 -72.68 -16.37 61.69 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.473 175.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.19 -20.58 36.21 Favored Glycine 0 CA--C 1.525 0.714 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.716 -178.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 14.4 m -58.72 -37.93 77.2 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.999 0.9 . . . . 0.0 109.882 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.78 -51.05 37.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.483 0.658 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.74 -34.92 76.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.232 0.539 . . . . 0.0 111.67 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.589 HD21 HE22 ' C' ' 710' ' ' GLN . 9.5 tt -59.12 -45.36 91.13 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.907 -0.496 . . . . 0.0 110.734 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.4 mt -66.08 -36.27 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 122.135 0.969 . . . . 0.0 108.844 179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.12 -29.53 69.3 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.834 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -54.94 -48.21 73.45 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.586 -0.697 . . . . 0.0 109.466 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.92 -45.48 64.19 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.14 -46.43 74.09 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -64.9 -29.74 70.7 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.819 -0.55 . . . . 0.0 112.372 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 80.0 p -75.71 -45.47 36.53 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.543 0.687 . . . . 0.0 110.95 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.439 ' O ' HD13 ' B' ' 774' ' ' LEU . 2.0 mp -61.07 -54.77 40.64 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 13.7 p -98.71 -49.62 4.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.528 0.68 . . . . 0.0 112.678 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 12.8 tp 71.1 99.66 0.06 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.718 0.77 . . . . 0.0 110.47 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 65.89 -80.94 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.207 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 17.6 p -84.31 158.32 21.22 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.638 -0.664 . . . . 0.0 110.558 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . 0.516 ' CE2' HD13 ' B' ' 771' ' ' LEU . 18.3 t80 -89.52 -31.76 17.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.96 0.409 . . . . 0.0 110.902 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.26 -37.71 64.99 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.999 0.904 . . . . 0.0 109.199 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -56.22 -29.77 61.41 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.546 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' B' ' 768' ' ' TYR . 10.0 tt -59.65 -41.0 89.54 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.905 -0.497 . . . . 0.0 109.698 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -57.74 -42.91 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.94 -46.17 90.5 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.439 HD13 ' O ' ' B' ' 763' ' ' LEU . 0.8 OUTLIER -59.25 -37.77 78.41 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.741 0.782 . . . . 0.0 109.997 178.284 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.624 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.5 OUTLIER -58.07 -36.91 73.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.074 -178.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 49.5 mt -70.71 -48.34 55.09 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.585 -0.697 . . . . 0.0 111.364 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 18.4 pt -62.58 -36.12 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.899 0.38 . . . . 0.0 109.98 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.411 HG23 HG12 ' C' ' 746' ' ' ILE . 0.4 OUTLIER -54.81 -45.79 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.11 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.606 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -63.83 -36.03 82.56 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.641 0.734 . . . . 0.0 110.492 178.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -67.08 -37.88 84.75 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 64.1 mt -63.92 -41.59 93.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.999 -0.438 . . . . 0.0 111.266 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.606 HG22 ' O ' ' B' ' 779' ' ' THR . 6.8 m -58.14 -38.58 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 121.282 -0.886 . . . . 0.0 110.176 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -59.97 -42.08 93.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.725 0.774 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.59 -43.36 85.1 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.605 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.783 HD23 ' HB2' ' C' ' 750' ' ' ASN . 5.9 tp -82.36 -18.31 42.56 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 122.05 -0.406 . . . . 0.0 111.604 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -50.76 -42.94 46.76 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 118.89 36.62 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.759 -179.414 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.538 HD13 HD11 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.429 ' N ' HD12 ' C' ' 661' ' ' LEU . 8.3 mp 59.02 109.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.712 0.768 . . . . 0.0 110.807 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -173.11 165.74 4.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.488 0.661 . . . . 0.0 110.243 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.677 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -50.7 -55.74 15.14 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.486 0.66 . . . . 0.0 110.591 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.677 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.6 t70 -71.03 -19.66 62.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.538 . . . . 0.0 112.384 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -80.61 -44.71 18.48 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.074 -0.391 . . . . 0.0 111.187 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -64.64 -45.76 85.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.407 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.24 -19.3 65.78 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.936 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 15.7 p -72.17 -28.63 63.35 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.815 -0.553 . . . . 0.0 111.327 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.33 -38.66 87.7 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 122.106 -0.372 . . . . 0.0 111.621 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -59.58 -29.79 68.2 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.599 -0.688 . . . . 0.0 110.985 -178.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -63.94 -31.99 73.36 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.472 0.653 . . . . 0.0 110.624 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -63.31 -41.65 98.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.495 0.664 . . . . 0.0 110.371 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 52.18 36.75 20.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.542 0.687 . . . . 0.0 111.334 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -146.59 -72.0 0.23 Allowed 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.604 -0.685 . . . . 0.0 111.338 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' C' ' 678' ' ' TRP . 6.2 tp -67.78 -37.5 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.952 -0.468 . . . . 0.0 110.981 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -52.24 -34.69 47.16 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -177.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -66.06 -50.15 65.17 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.712 -0.618 . . . . 0.0 110.451 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.426 ' CE3' HD12 ' C' ' 675' ' ' ILE . 1.3 t90 -65.81 -43.85 87.4 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 121.617 0.722 . . . . 0.0 109.727 178.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.469 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -64.05 -35.89 82.22 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.98 -8.0 22.81 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -97.81 -11.66 23.06 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.378 -0.826 . . . . 0.0 112.927 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.91 -36.6 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 O-C-N 121.744 -0.597 . . . . 0.0 110.499 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.517 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.8 ttt-85 -54.09 -47.42 71.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.776 0.322 . . . . 0.0 111.1 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.467 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.2 mp -68.81 -35.95 71.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.79 -32.37 70.55 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.92 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.923 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.61 -44.34 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.35 -41.62 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.88 -37.69 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.475 ' O ' HG23 ' C' ' 693' ' ' ILE . 94.0 t -54.95 -39.8 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.22 -42.52 82.44 Favored Glycine 0 C--N 1.346 1.137 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.4 -38.7 90.74 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.991 0.9 . . . . 0.0 109.021 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 tp -59.87 -43.99 94.42 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.083 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.475 HG23 ' O ' ' C' ' 689' ' ' VAL . 1.2 pp -65.63 -41.86 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.979 -0.45 . . . . 0.0 109.91 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -64.25 -27.74 71.99 Favored Glycine 0 CA--C 1.537 1.429 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.604 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -60.86 -39.46 89.25 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.877 0.846 . . . . 0.0 110.113 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.25 -29.17 60.72 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.744 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.1 OUTLIER -59.26 -36.21 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -176.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.604 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.3 p -54.38 -30.6 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.317 -0.864 . . . . 0.0 110.631 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -56.45 -31.32 63.86 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.999 -0.438 . . . . 0.0 110.281 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.72 79.0 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 177.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -43.44 92.8 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 122.07 0.938 . . . . 0.0 108.565 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.9 -37.67 87.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.403 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.3 m -62.76 -39.17 93.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.196 0.522 . . . . 0.0 110.343 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.494 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.7 OUTLIER -62.12 -44.98 95.46 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.21 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -61.62 -45.16 99.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.85 0.833 . . . . 0.0 108.892 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -62.6 -37.0 84.54 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.373 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.31 -49.78 71.29 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.23 -0.919 . . . . 0.0 109.817 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -36.02 23.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.36 0.6 . . . . 0.0 111.95 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -70.36 -44.25 68.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.589 HE22 HD21 ' B' ' 755' ' ' LEU . 0.0 OUTLIER -103.04 -21.49 13.92 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -179.046 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.01 178.54 17.8 Favored Glycine 0 CA--C 1.537 1.448 0 N-CA-C 110.194 -1.162 . . . . 0.0 110.194 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -132.9 -54.42 0.93 Allowed 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.896 -0.767 . . . . 0.0 112.328 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.448 ' HA ' HG21 ' B' ' 708' ' ' VAL . 1.7 m -71.66 142.0 85.62 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-O 118.776 -0.63 . . . . 0.0 109.309 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -30.06 96.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 123.101 2.534 . . . . 0.0 113.195 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.48 18.5 2.25 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.492 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.838 0.827 . . . . 0.0 109.647 -179.115 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.997 0.904 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 13.6 tpt85 -69.19 -26.47 64.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.143 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -64.71 -36.99 86.08 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.472 ' O ' HD12 ' C' ' 746' ' ' ILE . 42.6 ptt85 -74.34 -38.57 63.22 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.27 -37.47 75.05 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.941 -1.099 . . . . 0.0 109.337 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -71.43 -37.04 71.48 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.885 0.374 . . . . 0.0 110.475 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 18.9 p -67.94 -35.28 78.15 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.831 -0.543 . . . . 0.0 111.243 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.472 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -59.5 -22.2 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -59.47 -30.05 68.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.507 HD21 ' CG ' ' A' ' 714' ' ' PRO . 0.2 OUTLIER -61.74 -16.35 48.58 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.539 178.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 44.5 t -55.53 -54.47 25.2 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.783 ' HB2' HD23 ' B' ' 785' ' ' LEU . 1.6 m-80 -72.53 -24.64 61.17 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 122.223 1.011 . . . . 0.0 108.547 174.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -20.13 32.54 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.996 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 42.7 m -58.44 -40.71 83.32 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 117.546 0.673 . . . . 0.0 109.332 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 22.6 tp -62.85 -51.14 68.16 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -58.91 -34.4 71.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.713 0.768 . . . . 0.0 111.28 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.478 ' C ' HD23 ' C' ' 755' ' ' LEU . 10.0 tt -58.56 -45.25 89.35 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.489 -176.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . 0.431 HG22 HD12 ' C' ' 760' ' ' LEU . 2.3 mp -69.73 -29.54 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.68 -31.64 69.8 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -55.43 -47.17 76.38 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.937 -1.102 . . . . 0.0 109.622 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.59 -45.27 65.67 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . 0.431 HD12 HG22 ' C' ' 756' ' ' ILE . 14.0 mt -66.32 -45.98 78.47 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -177.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -66.61 -49.64 65.66 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 23.0 p -67.51 -40.89 85.14 Favored 'General case' 0 C--O 1.233 0.228 0 O-C-N 121.68 -0.637 . . . . 0.0 111.042 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -54.47 15.97 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.4 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -97.75 -49.37 4.85 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.304 -0.873 . . . . 0.0 112.331 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 6.5 tp 78.17 83.62 0.07 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 122.088 0.947 . . . . 0.0 111.042 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.17 -81.01 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.389 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 16.8 p -86.5 165.97 15.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.529 -0.732 . . . . 0.0 111.683 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -28.52 29.46 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.393 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -52.88 -37.16 60.14 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.964 0.888 . . . . 0.0 108.932 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 71.4 mmt-85 -69.31 -30.9 69.06 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.628 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.4 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.6 tt -60.97 -35.35 76.56 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.738 -0.601 . . . . 0.0 109.961 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -57.34 -35.18 69.58 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -63.06 -42.08 99.6 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.663 HD13 HG22 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -63.25 -38.52 91.47 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-O 122.057 0.932 . . . . 0.0 109.104 177.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.465 ' O ' HG22 ' C' ' 778' ' ' VAL . 0.2 OUTLIER -58.11 -43.18 87.02 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.737 -0.602 . . . . 0.0 110.036 -179.396 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.13 -35.58 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.337 0.589 . . . . 0.0 110.737 178.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.663 HG22 HD13 ' C' ' 774' ' ' LEU . 2.7 tt -65.17 -37.59 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.158 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.659 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -63.39 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.323 -0.861 . . . . 0.0 110.642 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.801 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.6 m -64.42 -48.72 74.28 Favored 'General case' 0 C--N 1.344 0.331 0 O-C-N 121.833 -0.542 . . . . 0.0 112.085 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -31.56 71.74 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.389 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . . . . . . . . . 19.6 mt -54.96 -36.15 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 122.215 -0.303 . . . . 0.0 110.649 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.801 HG22 ' O ' ' C' ' 779' ' ' THR . 23.0 m -52.87 -38.09 27.48 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 O-C-N 121.256 -0.902 . . . . 0.0 110.944 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -54.88 -41.31 70.71 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.333 0.587 . . . . 0.0 111.188 178.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 24.1 tp -68.83 -44.82 72.64 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.944 HD22 ' HB3' ' A' ' 747' ' ' ARG . 5.6 tp -74.99 -27.9 60.34 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 119.586 1.084 . . . . 0.0 110.926 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -41.63 -49.08 4.94 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -97.15 115.42 27.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.841 0.829 . . . . 0.0 109.654 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 10.3 tpt85 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.794 -178.953 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.489 ' CB ' HD23 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.689 0.757 . . . . 0.0 109.128 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 33.4 mt 59.52 106.75 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.978 0.894 . . . . 0.0 110.797 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 179.41 -178.62 0.37 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.18 -46.04 86.46 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 121.363 -0.836 . . . . 0.0 109.696 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.9 -33.02 73.91 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.463 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 -49.05 11.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 111.007 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -64.8 -40.72 95.7 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 110.685 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.05 -18.12 62.58 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.703 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -29.98 64.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.17 0.51 . . . . 0.0 111.001 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.401 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -59.78 -36.78 77.38 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.057 -0.402 . . . . 0.0 110.898 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -59.71 -17.4 34.33 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.884 0.373 . . . . 0.0 111.384 -179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -87.68 -29.02 21.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.334 0.588 . . . . 0.0 110.661 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -59.9 -48.97 79.51 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.681 0.753 . . . . 0.0 110.576 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 60.25 40.03 18.39 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.892 0.853 . . . . 0.0 110.58 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.4 -71.06 0.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.923 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.403 HD12 ' CE3' ' A' ' 678' ' ' TRP . 6.9 tp -68.25 -37.51 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 121.957 -0.464 . . . . 0.0 111.326 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.15 -35.73 49.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -64.71 -50.14 68.14 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.376 0.608 . . . . 0.0 110.568 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.568 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.7 t90 -65.53 -43.05 91.21 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.675 0.75 . . . . 0.0 109.997 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -35.62 81.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -102.82 -3.15 26.76 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -109.37 -5.61 15.77 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.346 0.975 . . . . 0.0 112.729 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 678' ' ' TRP . 10.7 pt -68.48 -36.13 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 110.779 179.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -53.26 -41.73 65.79 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.254 0.549 . . . . 0.0 110.047 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.478 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.4 mp -76.8 -34.96 23.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 177.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.481 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.4 t80 -59.84 -38.93 83.45 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.169 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.671 HG21 HD12 ' B' ' 686' ' ' ILE . 1.4 mp -60.6 -45.58 97.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 86.3 mt -61.73 -39.55 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.481 HD12 ' HA ' ' A' ' 685' ' ' PHE . 94.5 mt -59.85 -37.73 73.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.982 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 693' ' ' ILE . 93.3 t -54.85 -40.04 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.49 83.48 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 16.4 m -62.14 -38.68 89.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.04 0.924 . . . . 0.0 109.606 177.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.29 -39.33 86.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.923 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.667 HG22 HG21 ' C' ' 693' ' ' ILE . 0.9 OUTLIER -65.7 -43.17 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-O 121.153 0.501 . . . . 0.0 110.39 -178.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.88 -36.12 92.96 Favored Glycine 0 CA--C 1.535 1.321 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.1 tt -53.5 -38.7 63.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 122.278 1.037 . . . . 0.0 110.045 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -57.02 -28.82 62.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.091 0.956 . . . . 0.0 112.362 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 40.7 mt -59.51 -36.54 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 O-C-N 121.502 -0.749 . . . . 0.0 110.438 -176.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.797 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.5 p -66.49 -30.51 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.468 -0.77 . . . . 0.0 110.763 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -55.59 -28.53 55.61 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.547 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.4 -36.9 71.89 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.797 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.8 m -61.17 -36.6 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.533 -0.729 . . . . 0.0 109.578 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.9 tp -57.62 -37.64 73.61 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.995 -0.44 . . . . 0.0 110.429 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 16.0 m -62.24 -40.49 96.35 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.442 0.639 . . . . 0.0 109.997 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.426 HD13 HH22 ' A' ' 707' ' ' ARG . 0.4 OUTLIER -60.59 -43.17 97.68 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.449 HG22 HD12 ' A' ' 748' ' ' LEU . 78.4 t -64.71 -45.01 96.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 CA-C-O 121.858 0.837 . . . . 0.0 109.101 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.84 -36.2 80.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.876 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.426 HH22 HD13 ' A' ' 704' ' ' LEU . 2.1 tmm_? -65.71 -49.52 68.2 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.22 0.534 . . . . 0.0 111.668 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.423 HG23 ' NH2' ' A' ' 707' ' ' ARG . 1.0 OUTLIER -76.32 -44.06 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.921 0.867 . . . . 0.0 110.279 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -63.37 -22.09 66.67 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.449 ' NE2' HD21 ' C' ' 755' ' ' LEU . 2.4 mt-30 -92.85 -21.77 19.68 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.181 -0.949 . . . . 0.0 112.114 -178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 111.79 35.42 1.86 Allowed Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 71.97 -171.93 0.15 Allowed 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.28 1.038 . . . . 0.0 111.502 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 3.7 m -62.46 161.25 27.65 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.499 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -12.51 92.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 124.56 3.507 . . . . 0.0 115.692 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -106.83 -17.16 14.28 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.919 -179.533 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 78.8 p . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 122.292 1.044 . . . . 0.0 110.932 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-O 121.922 0.868 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -26.1 65.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.296 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -55.79 -6.79 0.24 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.22 -41.54 88.87 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.273 -0.892 . . . . 0.0 109.757 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.614 ' HA ' HD13 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -67.04 -45.19 78.2 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.143 0.497 . . . . 0.0 110.442 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -30.86 71.32 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.275 0.559 . . . . 0.0 110.651 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 13.1 p -67.53 -46.56 72.47 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.621 HG21 HD12 ' C' ' 781' ' ' ILE . 1.5 mt -61.46 -47.0 95.42 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.803 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.641 ' NE ' ' HA ' ' C' ' 782' ' ' VAL . 0.0 OUTLIER -64.91 -7.55 11.9 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 117.844 -1.543 . . . . 0.0 111.278 -177.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.475 HD23 ' HG3' ' B' ' 714' ' ' PRO . 0.2 OUTLIER -60.21 -14.82 19.61 Favored 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 171.092 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.604 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.291 1.6 t -53.06 -55.15 13.57 Favored 'Isoleucine or valine' 0 C--N 1.356 0.884 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 177.294 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.604 ' ND2' HG12 ' A' ' 749' ' ' VAL . 2.3 m-80 -73.32 -27.64 61.64 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.924 174.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.81 -19.59 29.56 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 89.0 p -57.49 -37.28 72.69 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.86 -48.09 82.11 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.66 -34.88 71.73 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.011 0.434 . . . . 0.0 110.54 177.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.85 -45.07 90.95 Favored 'General case' 0 C--N 1.345 0.397 0 O-C-N 121.981 -0.449 . . . . 0.0 111.412 -177.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.54 -33.08 55.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.16 -30.14 68.31 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.374 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.472 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 6.0 m-20 -55.16 -45.75 75.7 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.43 -0.794 . . . . 0.0 109.846 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.94 -44.35 69.75 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.473 0.654 . . . . 0.0 111.237 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -37.48 87.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -67.51 -44.56 78.15 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.245 0.545 . . . . 0.0 111.796 -178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.6 t -64.88 -45.18 87.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.962 0.887 . . . . 0.0 111.499 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.686 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -64.58 -54.15 36.58 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -177.786 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . 0.462 ' OG ' HD12 ' A' ' 771' ' ' LEU . 1.4 m -98.45 -22.99 15.74 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 8.9 tp 77.07 -60.53 0.46 Allowed 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.733 -0.604 . . . . 0.0 109.886 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.96 -67.72 0.29 Allowed 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.019 -0.425 . . . . 0.0 111.108 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.0 m -93.27 155.07 17.65 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.036 0.446 . . . . 0.0 110.531 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.97 -40.27 94.74 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.029 0.442 . . . . 0.0 110.323 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -53.94 -39.22 65.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.885 0.85 . . . . 0.0 109.664 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -58.47 -29.87 66.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.777 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.525 HD11 HD23 ' A' ' 763' ' ' LEU . 10.5 tt -59.56 -36.1 75.54 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.817 -0.552 . . . . 0.0 109.964 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 30.1 ttt180 -57.14 -33.34 67.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.484 0.659 . . . . 0.0 109.524 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -62.83 -42.36 99.7 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.817 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 763' ' ' LEU . 11.4 tp -58.83 -38.36 78.5 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 121.181 0.515 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.95 -39.83 93.44 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.158 0.504 . . . . 0.0 111.895 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . 0.544 ' O ' HG22 ' A' ' 779' ' ' THR . 39.6 mt -75.11 -42.16 57.02 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.81 -0.556 . . . . 0.0 112.395 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.555 HD11 HD12 ' A' ' 774' ' ' LEU . 1.1 pt -68.78 -37.51 77.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.731 -178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 774' ' ' LEU . 27.5 m -58.48 -42.65 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.543 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.688 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.9 t -63.57 -35.38 80.31 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 121.59 -0.694 . . . . 0.0 111.292 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -31.91 73.14 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.017 0.437 . . . . 0.0 111.692 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.437 ' CB ' HG21 ' B' ' 746' ' ' ILE . 24.4 mm -57.23 -41.97 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.996 -0.44 . . . . 0.0 111.439 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.688 HG22 ' O ' ' A' ' 779' ' ' THR . 10.4 m -54.95 -38.82 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.741 -0.6 . . . . 0.0 110.702 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -59.87 -48.84 80.07 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.327 0.584 . . . . 0.0 111.086 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.18 -43.37 70.92 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.4 -30.21 64.44 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 121.906 -0.496 . . . . 0.0 111.161 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.09 -30.39 23.5 Favored Glycine 0 CA--C 1.534 1.232 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 9.6 ptt180 -120.97 141.94 50.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.629 0.728 . . . . 0.0 110.975 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 . . . . . 0 C--O 1.22 -0.451 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.554 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.583 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.7 mm? 52.29 83.47 0.06 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.875 0.845 . . . . 0.0 110.539 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -150.79 157.81 43.39 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.685 0.755 . . . . 0.0 110.555 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.498 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.7 OUTLIER -47.0 -57.69 4.75 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 122.283 1.039 . . . . 0.0 111.559 -179.729 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.498 ' N ' HD23 ' B' ' 663' ' ' LEU . 12.3 m-20 -64.33 -28.92 70.04 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.437 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -71.62 -49.43 40.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.03 0.443 . . . . 0.0 110.401 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -61.95 -46.63 88.44 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.355 0.597 . . . . 0.0 110.518 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.36 -21.49 66.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.7 t -70.67 -32.9 70.34 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 111.038 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' B' ' 669' ' ' LEU . 4.4 mm? -60.46 -31.53 70.52 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.402 0.62 . . . . 0.0 111.087 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -59.61 -21.11 59.93 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.185 0.516 . . . . 0.0 111.321 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -86.8 -26.8 23.92 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.16 0.505 . . . . 0.0 111.216 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -60.13 -48.44 81.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.419 0.628 . . . . 0.0 110.853 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.2 t80 59.82 40.86 18.91 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 122.027 0.917 . . . . 0.0 110.817 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.61 -72.05 0.2 Allowed 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.856 -0.528 . . . . 0.0 110.687 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -68.42 -37.22 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 O-C-N 121.961 -0.462 . . . . 0.0 111.303 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 4.1 m -52.36 -33.96 45.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -69.02 -50.14 51.43 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.604 -0.685 . . . . 0.0 110.875 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.728 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.4 t90 -65.76 -44.26 86.4 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.824 0.821 . . . . 0.0 109.126 178.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.17 -35.89 81.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -95.9 -21.0 18.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -95.95 -5.27 41.72 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.285 -0.885 . . . . 0.0 112.17 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.728 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.3 pt -62.59 -36.65 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.721 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -53.04 -47.36 68.47 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.979 0.419 . . . . 0.0 110.62 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.474 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -66.57 -35.33 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.51 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -60.34 -31.12 70.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.957 179.475 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.671 HD12 HG21 ' A' ' 686' ' ' ILE . 19.2 mm -60.8 -44.72 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 109.856 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.34 -41.07 88.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.305 0.574 . . . . 0.0 109.502 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 87.0 mt -62.11 -38.79 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 685' ' ' PHE . 54.0 t -57.63 -39.71 71.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . 0.429 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -64.64 -26.77 71.18 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.4 m -60.62 -46.6 89.66 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.587 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.91 -33.34 71.74 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -176.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.587 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.1 OUTLIER -57.84 -41.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 -178.697 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.584 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.67 -34.3 88.08 Favored Glycine 0 CA--C 1.537 1.413 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.602 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.0 tt -59.72 -37.04 77.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 122.224 1.012 . . . . 0.0 110.506 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -55.93 -28.54 57.3 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.584 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.4 tt -58.63 -36.08 58.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 O-C-N 121.169 -0.957 . . . . 0.0 110.696 -176.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -54.52 -30.26 21.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 O-C-N 121.859 -0.526 . . . . 0.0 110.899 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -55.98 -30.0 61.1 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.729 -0.607 . . . . 0.0 110.389 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.42 -40.81 83.49 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.455 HG22 ' O ' ' B' ' 698' ' ' VAL . 1.3 m -69.35 -35.99 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 177.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tp -51.65 -37.76 51.81 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.815 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 43.0 m -62.82 -38.82 92.25 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.751 0.786 . . . . 0.0 109.948 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.454 HD22 ' NH1' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -62.13 -43.15 99.46 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.429 1.109 . . . . 0.0 108.801 178.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.581 HG22 HD11 ' B' ' 748' ' ' LEU . 57.6 t -67.67 -40.64 84.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.695 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' B' ' 710' ' ' GLN . 7.9 m-20 -62.4 -37.61 86.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.028 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.454 ' NH1' HD22 ' B' ' 704' ' ' LEU . 11.1 mtm105 -68.13 -44.31 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 122.152 0.977 . . . . 0.0 111.273 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.55 -45.35 33.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -65.88 -45.84 80.57 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 118.877 -1.129 . . . . 0.0 112.96 -175.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 0.9 OUTLIER -105.57 -24.16 12.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 -179.372 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.95 164.03 10.94 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 16.7 p90 -102.49 -61.58 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.5 p -65.55 158.81 72.01 Favored Pre-proline 0 N--CA 1.468 0.427 0 O-C-N 121.316 -0.865 . . . . 0.0 109.637 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.475 ' HG3' HD23 ' A' ' 748' ' ' LEU . 87.3 Cg_exo -29.32 118.59 0.05 OUTLIER 'Trans proline' 0 N--CA 1.496 1.676 0 C-N-CA 122.784 2.323 . . . . 0.0 112.981 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 758' ' ' ASP . 5.0 tt -83.65 -19.01 36.14 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 122.535 1.159 . . . . 0.0 111.282 -178.844 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 122.082 0.944 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 42.1 mtp85 -72.59 -25.87 61.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.254 -0.884 . . . . 0.0 113.201 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.13 -9.38 0.39 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -176.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 1.4 mtm105 -60.45 -37.62 81.54 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.406 -0.809 . . . . 0.0 110.175 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.22 -29.85 66.03 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.043 0.449 . . . . 0.0 109.95 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -49.39 43.44 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 121.532 0.682 . . . . 0.0 109.647 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -59.85 -33.92 72.44 Favored 'General case' 0 N--CA 1.46 0.068 0 O-C-N 122.026 -0.422 . . . . 0.0 110.214 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.437 HG21 ' CB ' ' A' ' 781' ' ' ILE . 1.5 mp -58.07 -22.02 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 31.8 ttt-85 -59.58 -17.32 31.89 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.581 HD11 HG22 ' B' ' 705' ' ' VAL . 7.2 tt -55.03 -27.04 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . 0.421 HG23 ' O ' ' B' ' 746' ' ' ILE . 94.7 t -55.05 -53.82 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.401 ' ND2' ' H ' ' B' ' 750' ' ' ASN . 3.5 m-80 -72.66 -24.32 61.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.331 -1.304 . . . . 0.0 109.837 175.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.54 37.81 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.242 -178.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 24.7 m -59.43 -38.7 81.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 117.857 0.828 . . . . 0.0 109.656 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 26.0 tp -69.54 -47.13 64.71 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.49 0.662 . . . . 0.0 110.179 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.59 -35.44 77.37 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.494 HD22 ' O ' ' B' ' 755' ' ' LEU . 1.7 tm? -59.51 -45.34 92.0 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.06 -0.4 . . . . 0.0 111.665 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.76 -36.81 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-O 121.377 0.608 . . . . 0.0 110.011 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.97 -30.59 69.05 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.483 ' OD2' HD23 ' C' ' 715' ' ' LEU . 85.7 m-20 -55.91 -49.75 72.59 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.04 -1.038 . . . . 0.0 109.934 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -70.8 -42.56 70.14 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.31 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.6 -45.98 70.54 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -65.36 -20.48 66.41 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . 0.472 ' O ' HD22 ' B' ' 774' ' ' LEU . 1.6 m -76.6 -45.64 29.37 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.768 -0.582 . . . . 0.0 111.326 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.36 -54.87 14.42 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 5.3 t -98.97 -49.83 4.39 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.855 0.836 . . . . 0.0 112.294 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.3 tt 63.86 89.34 0.09 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.825 0.822 . . . . 0.0 109.384 -177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 13.1 t80 72.74 122.11 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.514 0.673 . . . . 0.0 111.222 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.0 m 57.82 164.26 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.316 0.579 . . . . 0.0 111.451 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -109.84 64.31 0.61 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.781 1.277 . . . . 0.0 110.395 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.25 -42.51 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 122.474 1.13 . . . . 0.0 108.115 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -55.94 -29.03 59.5 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.527 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.738 ' O ' HD23 ' B' ' 771' ' ' LEU . 6.4 tt -59.38 -31.09 68.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.247 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -43.02 99.59 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -68.99 -45.2 71.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.43 0.634 . . . . 0.0 109.807 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.507 HD21 ' CZ ' ' C' ' 742' ' ' ARG . 0.1 OUTLIER -60.34 -37.87 81.98 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.752 0.787 . . . . 0.0 109.998 178.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.686 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.7 tm? -58.03 -36.8 73.24 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.673 -0.642 . . . . 0.0 110.007 -179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.4 mt -71.78 -38.22 70.33 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 122.103 -0.373 . . . . 0.0 111.884 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . 0.5 HG13 ' O ' ' B' ' 774' ' ' LEU . 1.4 pp -69.4 -37.45 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.52 -0.738 . . . . 0.0 109.877 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 83.5 t -60.53 -46.6 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.42 -0.8 . . . . 0.0 110.012 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.793 ' O ' HG22 ' B' ' 782' ' ' VAL . 2.6 t -63.85 -41.11 97.88 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.852 -0.53 . . . . 0.0 112.413 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.63 72.08 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.716 -0.615 . . . . 0.0 111.91 -178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 65.8 mt -57.88 -37.03 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 O-C-N 121.78 -0.575 . . . . 0.0 111.049 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 779' ' ' THR . 16.1 m -54.49 -38.14 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.301 -0.875 . . . . 0.0 110.012 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -64.33 -44.61 90.99 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.342 0.592 . . . . 0.0 110.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.1 tp -68.08 -42.12 80.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.467 0.651 . . . . 0.0 111.253 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.505 HD23 ' ND2' ' C' ' 750' ' ' ASN . 8.2 tp -76.98 -20.29 56.27 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.245 0.545 . . . . 0.0 111.275 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -55.84 -28.21 52.12 Favored Glycine 0 CA--C 1.534 1.229 0 O-C-N 122.005 -0.435 . . . . 0.0 112.107 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.17 128.24 54.53 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.809 -0.818 . . . . 0.0 110.633 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.454 179.524 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.792 0.806 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.6 142.9 11.24 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -173.2 176.0 3.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.443 0.639 . . . . 0.0 110.975 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.489 HD23 ' CB ' ' A' ' 660' ' ' LEU . 2.5 tm? -52.94 -46.54 68.18 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 122.036 0.922 . . . . 0.0 110.943 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -64.53 -26.62 68.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.58 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -81.14 -42.38 20.99 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 110.412 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -60.71 -44.79 96.16 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.583 0.706 . . . . 0.0 110.613 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.71 -26.65 64.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.208 0.528 . . . . 0.0 111.646 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.4 t -61.33 -30.32 70.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.98 -0.45 . . . . 0.0 112.07 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.488 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.7 mm? -66.7 -39.51 88.11 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -59.8 -27.65 66.77 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.649 -0.657 . . . . 0.0 111.091 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -66.3 -32.86 74.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.292 0.567 . . . . 0.0 110.129 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -63.87 -40.93 97.7 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.792 0.806 . . . . 0.0 109.637 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.1 t80 62.16 12.24 4.93 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.978 0.732 . . . . 0.0 112.978 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -136.72 -59.94 0.71 Allowed 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.566 -0.709 . . . . 0.0 112.592 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -63.41 -38.23 81.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.504 0.668 . . . . 0.0 110.731 -178.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.8 m -52.84 -38.57 61.61 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.173 0.511 . . . . 0.0 110.967 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -59.34 -49.05 79.3 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.622 0.725 . . . . 0.0 109.933 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.504 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -60.19 -43.4 95.92 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.167 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.21 -40.05 90.05 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -94.87 -10.04 32.5 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -94.6 -22.9 17.88 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.714 -0.616 . . . . 0.0 111.933 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.504 HG23 ' O ' ' C' ' 678' ' ' TRP . 13.4 pt -64.51 -36.9 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.93 -0.481 . . . . 0.0 110.738 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 7.5 ttt-85 -54.47 -47.22 73.22 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.281 0.562 . . . . 0.0 109.881 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.488 ' O ' HD13 ' C' ' 688' ' ' ILE . 1.8 mp -64.67 -34.48 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.7 OUTLIER -60.34 -37.27 80.12 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.737 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.601 HD12 HG22 ' B' ' 686' ' ' ILE . 10.9 mm -61.08 -47.19 94.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.103 0.478 . . . . 0.0 109.749 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 80.0 mt -60.04 -37.06 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.488 HD13 ' O ' ' C' ' 684' ' ' ILE . 1.2 mp -58.93 -38.87 75.98 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 65.4 t -58.55 -40.12 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.74 -36.29 65.17 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 12.1 m -67.31 -38.94 85.77 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 122.47 1.128 . . . . 0.0 110.222 178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.88 -46.49 89.16 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.425 -1.261 . . . . 0.0 114.053 -176.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.667 HG21 HG22 ' A' ' 693' ' ' ILE . 2.2 pp -59.91 -41.58 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 O-C-N 121.82 -0.55 . . . . 0.0 110.761 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.688 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.17 -37.06 92.33 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.97 -37.35 66.39 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.545 0.688 . . . . 0.0 109.955 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.552 HH22 HD12 ' B' ' 697' ' ' ILE . 25.4 mmt180 -56.71 -30.54 63.6 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.999 -0.438 . . . . 0.0 111.695 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.688 HG22 ' O ' ' C' ' 694' ' ' GLY . 13.4 tt -60.98 -36.89 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.8 t -67.13 -30.7 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.635 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -62.05 -30.99 71.36 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.108 0.48 . . . . 0.0 110.115 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.75 76.43 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 178.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -63.0 -39.71 86.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -37.98 87.46 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.677 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.0 m -62.82 -37.84 88.33 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.819 -0.551 . . . . 0.0 110.285 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.96 -41.71 98.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.813 0.816 . . . . 0.0 108.807 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.582 HG13 HD13 ' C' ' 748' ' ' LEU . 48.2 t -62.72 -44.67 99.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.266 1.031 . . . . 0.0 108.475 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -60.16 -35.6 75.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.117 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -47.95 83.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.707 0.765 . . . . 0.0 110.826 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -41.28 41.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.768 0.794 . . . . 0.0 110.769 -178.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -73.19 -33.6 65.51 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.684 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -102.29 -15.77 16.49 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -177.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 103.7 -173.06 21.54 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -132.22 -53.44 0.97 Allowed 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.544 -0.974 . . . . 0.0 112.749 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 8.4 m -93.94 146.5 31.78 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-O 118.28 -0.867 . . . . 0.0 109.641 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -31.31 93.56 0.01 OUTLIER 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.623 2.215 . . . . 0.0 112.811 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.483 HD23 ' OD2' ' B' ' 758' ' ' ASP . 17.2 tp -73.68 -10.42 59.67 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . 0.439 ' C ' ' O ' ' C' ' 715' ' ' LEU . 14.2 t . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 121.19 0.519 . . . . 0.0 112.29 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -26.43 62.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.51 -47.85 82.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.507 ' CZ ' HD21 ' B' ' 774' ' ' LEU . 24.3 ttp85 -63.88 -36.83 85.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -177.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -58.73 -34.14 71.01 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.029 1.286 . . . . 0.0 109.268 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -71.22 -32.73 69.14 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.489 0.662 . . . . 0.0 109.655 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 5.0 p -66.5 -47.31 73.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.92 0.39 . . . . 0.0 110.078 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.0 mp -53.98 -41.07 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 O-C-N 121.404 -0.81 . . . . 0.0 110.737 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -60.99 -16.13 39.61 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 118.372 -1.331 . . . . 0.0 110.417 -178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.582 HD13 HG13 ' C' ' 705' ' ' VAL . 0.9 OUTLIER -63.27 -19.26 64.41 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.726 -0.609 . . . . 0.0 109.362 176.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.0 t -55.21 -54.03 28.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.725 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.505 ' ND2' HD23 ' B' ' 785' ' ' LEU . 3.4 m-80 -72.53 -27.12 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.816 174.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.31 -20.67 37.46 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.53 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 97.8 p -58.69 -38.82 79.07 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.038 -0.684 . . . . 0.0 109.356 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 20.8 tp -67.07 -49.02 66.46 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . 0.46 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.45 -35.42 74.02 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.644 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.532 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.9 tm? -59.65 -45.34 92.31 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.837 -0.539 . . . . 0.0 110.706 -178.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 78.9 mt -62.35 -41.39 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.478 0.656 . . . . 0.0 109.266 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -68.4 -30.86 69.87 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.11 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -55.65 -49.48 72.77 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.347 -0.846 . . . . 0.0 110.009 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -71.12 -45.02 64.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.493 0.663 . . . . 0.0 111.049 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.44 -44.15 96.09 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -74.46 -47.5 33.11 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -177.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 79.3 p -67.34 -43.75 80.75 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.85 0.833 . . . . 0.0 111.196 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.417 ' HG ' HD22 ' C' ' 774' ' ' LEU . 8.7 tt -59.73 -53.22 60.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.636 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 34.3 m -96.79 -13.43 22.62 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 9.0 mt 57.27 67.69 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.954 0.883 . . . . 0.0 110.717 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 59.3 t80 79.07 -89.62 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 61.8 m -93.78 171.79 8.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.305 -0.872 . . . . 0.0 111.986 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.28 -33.61 67.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.224 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -54.4 -35.08 62.49 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.019 0.914 . . . . 0.0 108.812 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -72.25 -30.17 64.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.798 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -60.06 -35.13 74.47 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -33.9 67.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -41.36 98.85 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.486 HD11 HD11 ' A' ' 746' ' ' ILE . 6.7 tp -59.35 -38.98 81.76 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-O 121.142 0.496 . . . . 0.0 109.717 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.477 ' O ' HG12 ' C' ' 778' ' ' VAL . 1.8 mm? -58.91 -42.55 89.92 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.365 0.602 . . . . 0.0 110.729 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 35.8 mt -74.52 -37.21 63.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 109.668 178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.626 ' O ' HG13 ' C' ' 781' ' ' ILE . 71.4 mt -61.39 -49.06 86.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.123 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.477 HG12 ' O ' ' C' ' 775' ' ' LEU . 7.5 p -54.76 -39.18 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.753 ' O ' HG22 ' C' ' 782' ' ' VAL . 8.3 m -63.61 -43.16 97.69 Favored 'General case' 0 C--N 1.335 -0.052 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.679 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -31.86 72.02 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.626 HG13 ' O ' ' C' ' 777' ' ' ILE . 11.5 mt -56.48 -36.27 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.838 -0.539 . . . . 0.0 110.968 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.753 HG22 ' O ' ' C' ' 779' ' ' THR . 18.0 m -52.47 -37.86 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 121.432 -0.792 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.79 -41.59 87.05 Favored 'General case' 0 CA--C 1.553 1.07 0 O-C-N 121.452 -0.78 . . . . 0.0 111.465 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.6 -44.51 81.93 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 -176.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.444 ' HB3' ' HD2' ' A' ' 747' ' ' ARG . 6.5 tp -71.28 -37.35 71.87 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.115 -0.99 . . . . 0.0 109.525 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.08 -33.34 37.12 Favored Glycine 0 CA--C 1.532 1.129 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.82 127.81 34.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.22 -0.447 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.327 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.553 ' HB2' HD21 ' C' ' 663' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 120.312 0.101 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.7 mt 170.25 119.65 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.505 -0.747 . . . . 0.0 109.576 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.06 -174.16 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.73 -0.606 . . . . 0.0 109.881 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.547 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.6 OUTLIER -54.34 -40.07 67.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.562 0.696 . . . . 0.0 109.855 179.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . 0.434 ' N ' HD23 ' A' ' 663' ' ' LEU . 0.6 OUTLIER -69.8 -34.74 74.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.779 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -73.53 -44.58 57.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.44 0.638 . . . . 0.0 110.657 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -72.8 -46.26 54.17 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.185 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.97 -30.58 70.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.084 0.469 . . . . 0.0 111.658 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 4.0 m -65.22 -32.34 73.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.255 0.55 . . . . 0.0 111.005 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.7 -30.57 71.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.861 0.362 . . . . 0.0 111.565 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -59.45 -24.46 63.55 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.708 -0.62 . . . . 0.0 111.195 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -73.3 -22.34 60.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.085 0.469 . . . . 0.0 111.265 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.9 m95 -64.48 -45.28 88.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-O 121.154 0.502 . . . . 0.0 111.171 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . 0.427 ' CG ' ' O ' ' A' ' 673' ' ' PHE . 49.3 t80 60.67 10.03 2.43 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.394 0.616 . . . . 0.0 111.027 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -123.9 -66.94 0.96 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.988 -1.07 . . . . 0.0 111.269 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.98 -37.67 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 O-C-N 122.059 -0.401 . . . . 0.0 111.392 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.5 m -52.7 -38.6 60.93 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -61.79 -50.07 73.83 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 121.271 0.558 . . . . 0.0 110.433 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.61 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.3 t90 -65.52 -39.35 91.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.78 0.8 . . . . 0.0 109.654 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -35.93 81.83 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -104.98 -20.01 13.66 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -84.75 -14.46 48.19 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.282 -0.886 . . . . 0.0 111.84 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.61 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.0 pt -60.82 -35.8 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 121.243 0.544 . . . . 0.0 110.513 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 14.2 ttt-85 -53.06 -47.02 68.77 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.151 -0.343 . . . . 0.0 110.346 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -65.96 -32.01 56.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -62.79 -29.86 71.03 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.158 179.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.805 HD12 HG21 ' C' ' 686' ' ' ILE . 21.2 mm -60.72 -45.4 97.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.16 0.505 . . . . 0.0 110.188 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.8 mt -71.12 -37.65 67.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.138 0.494 . . . . 0.0 109.776 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.02 -37.66 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 122.053 -0.404 . . . . 0.0 110.174 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 685' ' ' PHE . 67.4 t -54.61 -39.91 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -58.87 -38.77 93.0 Favored Glycine 0 CA--C 1.533 1.178 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 177.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.0 m -64.46 -38.3 90.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.815 0.817 . . . . 0.0 109.63 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -45.5 91.48 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.772 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.638 HG13 HG22 ' B' ' 693' ' ' ILE . 0.2 OUTLIER -67.38 -40.96 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.721 -179.2 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . 0.487 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -60.78 -21.62 58.64 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 177.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.517 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -62.53 -37.61 86.77 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.813 0.816 . . . . 0.0 109.788 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 3.0 mmt180 -55.02 -28.4 51.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 694' ' ' GLY . 20.4 tt -59.2 -36.79 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 O-C-N 120.559 -1.338 . . . . 0.0 109.427 -177.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.745 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -67.38 -30.92 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-O 121.514 0.673 . . . . 0.0 110.038 177.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.2 m-85 -55.61 -28.53 55.72 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.334 0.588 . . . . 0.0 109.733 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.0 -36.91 70.95 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.745 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.6 m -62.19 -35.72 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 O-C-N 121.59 -0.694 . . . . 0.0 109.485 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.6 -39.21 87.31 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.029 -0.419 . . . . 0.0 110.205 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -62.62 -33.82 75.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.512 0.672 . . . . 0.0 109.854 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.1 OUTLIER -62.9 -43.13 99.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.402 1.096 . . . . 0.0 108.745 177.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.825 HG22 HD23 ' A' ' 748' ' ' LEU . 67.1 t -67.77 -45.21 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.201 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.42 -37.08 84.43 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.512 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.431 ' CZ ' ' HE ' ' B' ' 707' ' ' ARG . 34.4 ttm180 -60.19 -49.46 77.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.894 0.854 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -43.05 49.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.001 0.905 . . . . 0.0 109.423 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.1 -14.59 61.88 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -98.41 7.68 45.87 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.011 -1.056 . . . . 0.0 113.427 -178.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 81.38 12.33 82.17 Favored Glycine 0 CA--C 1.543 1.829 0 O-C-N 121.886 -0.509 . . . . 0.0 112.374 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.411 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.6 OUTLIER 61.94 -123.24 0.76 Allowed 'General case' 0 CA--C 1.564 1.492 0 O-C-N 121.648 -0.913 . . . . 0.0 110.774 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.411 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 13.4 p -62.22 159.1 41.78 Favored Pre-proline 0 C--N 1.355 0.832 0 O-C-N 120.732 -1.23 . . . . 0.0 110.625 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.413 ' HG3' ' HG ' ' C' ' 748' ' ' LEU . 84.8 Cg_exo -44.59 109.04 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.68 1.587 . . . . 0.0 112.836 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.22 -19.1 13.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.512 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 14.4 p . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 122.565 1.174 . . . . 0.0 110.427 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.838 0.828 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -25.62 62.65 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.71 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.54 -13.28 0.91 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 69.3 mtm-85 -69.19 -46.68 66.86 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.458 -0.777 . . . . 0.0 109.255 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.77 -41.46 86.67 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.746 0.784 . . . . 0.0 110.267 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . 0.858 ' HA ' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -69.31 -35.47 76.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.444 -0.785 . . . . 0.0 111.192 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.33 -38.39 81.49 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.07 -0.394 . . . . 0.0 111.793 -179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.762 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.5 mp -64.2 -47.1 91.38 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.258 0 CA-C-O 116.566 -1.683 . . . . 0.0 113.923 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.72 ' CB ' HD23 ' C' ' 785' ' ' LEU . 0.2 OUTLIER -64.78 -11.22 34.36 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 122.471 2.396 . . . . 0.0 110.644 -176.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.825 HD23 HG22 ' A' ' 705' ' ' VAL . 57.5 tp -56.15 -14.93 3.05 Favored 'General case' 0 CA--C 1.562 1.429 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 746' ' ' ILE 0.273 1.5 t -53.75 -54.17 21.37 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.43 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.9 m-80 -72.36 -28.87 63.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 122.566 1.174 . . . . 0.0 108.289 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.661 ' HA3' HD12 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.32 Favored Glycine 0 C--N 1.339 0.726 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.181 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 79.8 p -57.36 -37.32 72.41 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.9 tp -61.51 -47.49 85.38 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.13 -35.8 76.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.764 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.475 ' O ' HD23 ' A' ' 755' ' ' LEU . 6.7 tt -62.24 -45.34 93.76 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.292 0.568 . . . . 0.0 110.275 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . 0.412 HG22 HD12 ' A' ' 760' ' ' LEU . 52.8 mt -61.29 -36.88 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -69.45 -30.81 68.81 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.236 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.562 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 79.2 m-20 -57.9 -49.22 77.47 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.614 -0.679 . . . . 0.0 109.938 -178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -70.8 -43.42 68.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.019 0.528 . . . . 0.0 112.256 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.412 HD12 HG22 ' A' ' 756' ' ' ILE . 10.6 mt -68.73 -46.28 69.32 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 121.595 0.712 . . . . 0.0 112.565 -178.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 8.1 ttm105 -63.23 -25.4 68.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.292 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 61.6 p -74.3 -45.15 49.42 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.572 -0.705 . . . . 0.0 111.158 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.775 ' HA ' HD22 ' A' ' 774' ' ' LEU . 1.0 OUTLIER -67.33 -55.52 13.49 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.092 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.43 -49.14 4.53 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.709 0.766 . . . . 0.0 112.173 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.476 ' C ' HD23 ' A' ' 765' ' ' LEU . 5.4 tt 82.98 -78.18 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.875 0.87 . . . . 0.0 111.644 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -109.99 -70.65 0.8 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.624 -0.672 . . . . 0.0 111.568 -178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.9 m -97.86 144.41 27.47 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.142 0.496 . . . . 0.0 110.604 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CE1' HD22 ' A' ' 771' ' ' LEU . 15.6 t80 -60.98 -29.54 69.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.997 0.427 . . . . 0.0 110.419 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -55.94 -36.65 68.0 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.882 0.849 . . . . 0.0 109.226 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -55.91 -29.6 60.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.671 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.69 HD11 HD23 ' A' ' 763' ' ' LEU . 29.5 tp -59.65 -43.53 93.87 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -59.53 -40.04 85.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.574 0.702 . . . . 0.0 109.394 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -68.0 -45.37 74.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.83 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.775 HD22 ' HA ' ' A' ' 763' ' ' LEU . 0.2 OUTLIER -63.16 -38.41 91.05 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 121.392 0.615 . . . . 0.0 110.707 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.7 tt -60.33 -39.88 88.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.9 -0.5 . . . . 0.0 111.168 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.9 mt -67.19 -40.64 86.55 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 17.8 pt -60.26 -36.93 71.69 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.56 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 35.2 t -55.59 -46.41 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.774 -0.579 . . . . 0.0 109.597 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.804 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.2 OUTLIER -63.92 -41.53 97.63 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.188 0.518 . . . . 0.0 110.856 179.358 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -31.87 72.49 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.44 -36.75 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 O-C-N 121.714 -0.616 . . . . 0.0 111.078 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 779' ' ' THR . 13.4 m -54.73 -40.26 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 O-C-N 121.471 -0.768 . . . . 0.0 111.46 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -65.28 -42.0 93.6 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.68 0.753 . . . . 0.0 111.178 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.9 tp -69.15 -38.79 78.95 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.327 0.584 . . . . 0.0 111.035 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.547 HD11 ' HG3' ' B' ' 747' ' ' ARG . 0.3 OUTLIER -78.53 -22.3 47.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.871 0.367 . . . . 0.0 111.312 -179.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.09 -39.75 12.58 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.9 128.59 35.36 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.493 0.663 . . . . 0.0 110.48 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 12.7 ttp-105 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.08 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.547 ' N ' HD12 ' A' ' 663' ' ' LEU . 3.0 tt . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.557 0.694 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.9 mp 61.02 103.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.575 0.702 . . . . 0.0 110.556 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -167.11 175.16 7.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.511 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.82 HD12 HD23 ' C' ' 660' ' ' LEU . 8.9 tt -53.59 -41.41 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.549 0.69 . . . . 0.0 110.363 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -73.31 -31.46 64.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.68 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -46.78 50.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.347 0.594 . . . . 0.0 110.777 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -64.38 -46.28 84.05 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.589 0.709 . . . . 0.0 110.394 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.37 -24.43 67.64 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.4 t -63.18 -35.01 78.89 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.229 0.537 . . . . 0.0 110.923 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.449 HD12 HG23 ' B' ' 675' ' ' ILE . 4.2 mm? -59.84 -28.12 67.22 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.211 0.529 . . . . 0.0 111.233 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.1 m95 -62.23 -23.53 66.71 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.048 0.452 . . . . 0.0 111.379 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -88.04 -26.6 22.49 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.238 0.542 . . . . 0.0 111.512 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -59.16 -49.11 79.12 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 111.014 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 59.3 41.34 20.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.799 0.809 . . . . 0.0 110.644 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -153.64 -71.33 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.802 -0.561 . . . . 0.0 111.224 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.465 HG13 HD23 ' B' ' 679' ' ' LEU . 6.5 tp -65.68 -37.21 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 O-C-N 121.869 -0.519 . . . . 0.0 111.344 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.26 -33.72 43.02 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -64.01 -49.88 70.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.439 0.638 . . . . 0.0 110.116 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.484 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.0 t90 -65.68 -39.86 91.75 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.828 0.823 . . . . 0.0 109.622 178.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.465 HD23 HG13 ' B' ' 675' ' ' ILE . 0.6 OUTLIER -66.12 -35.6 80.92 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.033 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -102.02 -31.2 10.77 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -68.81 -27.01 65.47 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.514 -0.741 . . . . 0.0 111.481 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.735 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.7 pp -60.42 -36.08 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 O-C-N 122.091 -0.381 . . . . 0.0 110.889 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . 0.735 ' N ' HD12 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -53.64 -47.23 70.51 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.281 0.563 . . . . 0.0 110.044 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.522 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.0 mp -76.06 -36.95 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -28.58 67.49 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.43 -44.78 96.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.54 -43.76 98.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.29 -37.86 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.433 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.407 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 42.4 t -55.81 -39.44 56.23 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -63.63 -27.46 71.02 Favored Glycine 0 CA--C 1.543 1.842 0 O-C-N 121.766 -0.584 . . . . 0.0 112.273 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 46.6 m -60.55 -44.55 96.0 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.624 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.43 -31.55 69.39 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 121.597 -0.69 . . . . 0.0 112.068 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.638 HG22 HG13 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -57.16 -44.69 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 O-C-N 121.438 -0.789 . . . . 0.0 109.237 -177.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.04 -32.07 80.94 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.442 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -55.54 -36.86 67.23 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.785 0.803 . . . . 0.0 109.89 178.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.415 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 17.1 mmt180 -54.67 -27.68 41.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.728 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.17 -36.02 55.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 O-C-N 120.85 -1.156 . . . . 0.0 109.325 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.442 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.0 p -61.78 -30.5 48.56 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 O-C-N 121.218 -0.926 . . . . 0.0 110.424 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 11.6 m-85 -56.62 -31.41 64.28 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.708 -0.62 . . . . 0.0 110.429 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.34 88.06 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.17 -38.78 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.13 -39.95 91.94 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.363 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -68.37 -33.59 74.54 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.579 0.704 . . . . 0.0 110.01 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -42.78 93.09 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.158 0.98 . . . . 0.0 108.956 178.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.16 -45.13 77.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 122.153 0.977 . . . . 0.0 109.176 178.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.53 -36.59 83.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.336 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.431 ' HE ' ' CZ ' ' A' ' 707' ' ' ARG . 18.3 ttm180 -62.07 -47.12 86.1 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.25 1.024 . . . . 0.0 109.485 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 1.6 t -70.28 -44.4 77.7 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.038 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -60.47 -44.97 95.34 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.562 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.4 pt20 -104.46 -24.46 13.04 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.11 176.18 14.35 Favored Glycine 0 CA--C 1.537 1.423 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' A' ' 704' ' ' LEU . 0.9 OUTLIER -96.03 -65.05 1.0 Allowed 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.727 -0.867 . . . . 0.0 111.596 -179.224 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 42.9 p -69.48 159.61 82.82 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.353 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.594 ' HG3' HD13 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -31.63 142.3 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.361 2.041 . . . . 0.0 113.152 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.479 ' O ' HD23 ' B' ' 715' ' ' LEU . 8.3 tt -95.2 -18.9 20.5 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -177.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 715' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 122.326 1.06 . . . . 0.0 112.505 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.464 0.65 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -57.99 -26.32 62.2 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.332 0.587 . . . . 0.0 112.369 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -52.34 63.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.62 ' NH2' HD11 ' A' ' 774' ' ' LEU . 9.9 ptt85 -77.72 -34.47 52.66 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -45.06 90.6 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.093 -1.004 . . . . 0.0 108.809 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -71.46 -34.05 69.87 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.283 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 4.3 p -57.28 -38.29 73.7 Favored 'General case' 0 C--N 1.344 0.342 0 O-C-N 122.075 -0.391 . . . . 0.0 110.601 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.412 ' O ' HG23 ' B' ' 749' ' ' VAL . 28.5 mt -54.1 -19.87 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.553 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.547 ' HG3' HD11 ' A' ' 785' ' ' LEU . 3.0 ttt85 -59.85 -29.68 68.45 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.69 -18.67 8.57 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 122.109 -0.37 . . . . 0.0 110.063 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . 0.412 HG23 ' O ' ' B' ' 746' ' ' ILE . 43.9 t -56.04 -54.53 26.09 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 177.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.469 ' ND2' HD22 ' A' ' 785' ' ' LEU . 4.3 m-80 -73.07 -22.11 60.66 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.298 -1.319 . . . . 0.0 110.27 174.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.9 -19.84 31.21 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.228 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 6.9 m -58.25 -37.47 74.99 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.799 -0.824 . . . . 0.0 108.968 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.4 tp -66.01 -51.02 62.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.299 0.571 . . . . 0.0 109.757 178.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.37 -36.38 83.83 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.42 HD21 ' NE2' ' C' ' 710' ' ' GLN . 6.0 tt -59.96 -45.0 94.07 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.854 -0.529 . . . . 0.0 111.005 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -65.14 -34.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.711 0.767 . . . . 0.0 109.032 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.5 -30.29 68.11 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.724 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.402 ' OD1' HD22 ' C' ' 715' ' ' LEU . 37.9 m-20 -55.33 -47.96 74.89 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.323 -0.861 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.35 -45.25 66.49 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.105 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.4 mt -66.73 -46.5 75.28 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . 0.407 ' O ' ' HA ' ' B' ' 765' ' ' LEU . 26.5 mtm180 -66.65 -22.76 66.1 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 11.8 t -76.82 -45.1 29.9 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.521 0.677 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.856 ' HA ' HD22 ' B' ' 774' ' ' LEU . 5.1 mp -66.77 -54.6 21.11 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -178.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . 0.554 ' C ' HD12 ' B' ' 765' ' ' LEU . 12.9 p -98.56 -23.39 15.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . 0.554 HD12 ' C ' ' B' ' 764' ' ' SER . 5.2 mp 70.37 -66.9 0.26 Allowed 'General case' 0 N--CA 1.482 1.146 0 O-C-N 121.731 -0.606 . . . . 0.0 110.996 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -130.22 -67.06 0.75 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.783 -0.573 . . . . 0.0 110.997 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 7.3 m -97.66 146.44 25.33 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.332 0.587 . . . . 0.0 110.739 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.98 -31.96 70.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.939 0.4 . . . . 0.0 110.599 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -53.67 -39.08 64.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.822 0.82 . . . . 0.0 109.542 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.57 -29.65 64.62 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.279 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.432 ' O ' HD23 ' B' ' 771' ' ' LEU . 5.7 tt -59.5 -43.26 93.38 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -37.27 75.62 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.67 -48.74 75.96 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.856 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.1 OUTLIER -58.83 -38.12 77.95 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 121.82 0.819 . . . . 0.0 110.05 178.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.693 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -58.28 -36.66 73.62 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 121.784 -0.573 . . . . 0.0 110.507 -179.096 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . 0.42 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.32 -31.28 67.23 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 22.5 pt -70.27 -36.69 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 121.471 -0.768 . . . . 0.0 109.792 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 39.2 t -55.53 -46.04 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 121.666 -0.646 . . . . 0.0 111.15 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.42 HG22 ' O ' ' B' ' 776' ' ' LEU . 12.4 t -63.31 -42.67 99.04 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.814 -0.754 . . . . 0.0 111.997 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -37.41 81.54 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.573 -0.705 . . . . 0.0 111.15 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.92 -47.14 94.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 O-C-N 122.05 -0.406 . . . . 0.0 111.32 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.1 -38.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.488 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.17 -46.03 89.45 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.721 0.772 . . . . 0.0 109.771 178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 31.2 tp -68.7 -40.55 79.98 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.975 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.465 HD23 ' CG ' ' C' ' 750' ' ' ASN . 1.3 tp -78.01 -16.79 57.8 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.98 0.419 . . . . 0.0 111.787 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -49.3 -37.46 24.76 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 -106.12 122.55 46.41 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 122.179 -0.601 . . . . 0.0 110.641 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.67 -179.747 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.82 HD23 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.418 0.628 . . . . 0.0 109.578 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.0 mp -132.13 158.19 42.3 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.391 0.615 . . . . 0.0 111.056 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.66 166.04 2.13 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.664 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.5 tm? -58.37 -48.52 80.35 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.924 0.869 . . . . 0.0 110.089 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.22 -21.82 66.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.52 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -41.44 22.0 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -61.63 -46.45 89.75 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.533 0.682 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.82 -31.91 68.9 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.616 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -57.87 -38.13 75.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.47 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -61.31 -29.31 69.8 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.066 0.46 . . . . 0.0 111.764 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 41.7 m95 -59.53 -28.87 67.46 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.965 -0.46 . . . . 0.0 111.198 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -77.68 -25.1 49.27 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 122.013 -0.43 . . . . 0.0 111.748 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.22 -42.22 90.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.426 0.631 . . . . 0.0 110.579 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.2 t80 53.58 30.97 11.63 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.098 0.475 . . . . 0.0 111.833 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -151.46 -69.85 0.17 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.508 -0.745 . . . . 0.0 112.471 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.62 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -68.31 -37.19 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.474 0.654 . . . . 0.0 111.515 -178.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -51.93 -33.72 38.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.462 -178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -57.08 -49.02 77.14 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.628 0.727 . . . . 0.0 109.576 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.604 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.8 t90 -64.78 -44.22 90.68 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 122.004 -0.435 . . . . 0.0 110.416 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.15 -36.1 82.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -98.11 -15.42 19.97 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -98.44 -11.92 21.87 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.329 -0.857 . . . . 0.0 112.295 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.604 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.1 pt -61.06 -36.4 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 121.788 -0.57 . . . . 0.0 110.872 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 8.9 ttt-85 -53.45 -47.32 69.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.962 0.41 . . . . 0.0 110.132 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.453 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.9 -34.05 67.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.488 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.79 -33.37 71.63 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.335 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.805 HG21 HD12 ' A' ' 686' ' ' ILE . 11.6 mm -60.64 -46.74 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.31 -39.55 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.8 -37.12 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.429 HG23 ' O ' ' C' ' 685' ' ' PHE . 78.4 t -54.38 -39.74 45.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.2 -38.98 80.04 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.3 m -67.41 -38.47 84.68 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 122.237 1.018 . . . . 0.0 109.421 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.0 tp -59.74 -46.17 89.95 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.261 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -67.84 -41.61 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.044 -0.41 . . . . 0.0 111.105 -178.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.692 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.34 -29.85 69.91 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.597 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.4 tt -63.01 -37.6 87.83 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 122.005 0.907 . . . . 0.0 110.25 178.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -55.75 -28.4 55.74 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.692 HG22 ' O ' ' C' ' 694' ' ' GLY . 20.2 tt -58.61 -35.51 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.426 -0.796 . . . . 0.0 111.532 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.597 HG12 ' O ' ' C' ' 695' ' ' LEU . 11.0 p -53.97 -29.94 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 O-C-N 121.469 -0.769 . . . . 0.0 110.103 179.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -55.99 -31.5 63.09 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.808 -0.558 . . . . 0.0 110.336 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.47 -37.68 78.84 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.13 -39.28 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.87 -37.22 86.0 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.022 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 52.6 p -62.9 -36.14 82.39 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.761 -0.587 . . . . 0.0 110.621 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -40.49 93.94 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 108.832 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.27 -43.75 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -62.38 -35.66 79.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.364 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -59.52 -51.03 71.61 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.969 0.89 . . . . 0.0 110.355 -178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -45.56 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.925 0.869 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -73.81 -38.09 64.69 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.42 ' NE2' HD21 ' B' ' 755' ' ' LEU . 10.2 tt0 -102.63 -2.52 28.19 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 86.45 -176.13 48.03 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -139.19 -57.96 0.6 Allowed 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.585 -0.95 . . . . 0.0 112.548 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 14.9 p -81.41 149.17 64.63 Favored Pre-proline 0 C--N 1.338 0.103 0 CA-C-O 118.335 -0.84 . . . . 0.0 109.644 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -30.64 94.64 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.429 2.086 . . . . 0.0 112.566 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.402 HD22 ' OD1' ' B' ' 758' ' ' ASP . 0.5 OUTLIER -81.52 16.78 1.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.305 -176.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 121.806 0.812 . . . . 0.0 110.34 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 121.66 0.743 . . . . 0.0 111.546 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -72.14 -26.68 62.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.848 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -61.56 -8.26 4.16 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.855 -0.528 . . . . 0.0 112.395 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.542 ' NE ' HD11 ' B' ' 774' ' ' LEU . 63.7 mtm-85 -71.76 -45.27 62.21 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.724 -0.61 . . . . 0.0 111.677 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.4 -38.62 77.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.877 -0.515 . . . . 0.0 109.796 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.12 -42.47 69.18 Favored 'General case' 0 N--CA 1.457 -0.084 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.2 p -58.35 -43.09 88.17 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 122.088 -0.383 . . . . 0.0 110.935 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -57.3 -21.03 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 O-C-N 121.667 -0.645 . . . . 0.0 109.448 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -59.74 -26.3 65.54 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 109.097 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.482 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.0 OUTLIER -55.5 -24.25 30.48 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.861 0.362 . . . . 0.0 110.104 178.553 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.66 -54.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.35 0.627 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.465 ' CG ' HD23 ' B' ' 785' ' ' LEU . 3.0 m-80 -72.3 -24.93 61.4 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.892 0.853 . . . . 0.0 109.19 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.33 -20.75 37.89 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.905 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 1.9 m -58.81 -37.92 77.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.921 0.86 . . . . 0.0 109.775 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 19.1 tp -67.04 -51.42 55.0 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.479 0.657 . . . . 0.0 109.935 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.93 -34.84 78.88 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.413 0.625 . . . . 0.0 111.828 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 8.7 tt -59.36 -45.11 92.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.101 0.477 . . . . 0.0 110.867 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.9 mm -69.04 -34.83 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.517 0.675 . . . . 0.0 109.427 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.26 -30.76 68.94 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -55.76 -49.07 74.11 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 121.033 -1.042 . . . . 0.0 109.987 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -70.47 -44.77 67.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.448 0.642 . . . . 0.0 111.648 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -40.92 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -78.85 -35.57 43.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 15.4 p -64.54 -45.39 87.38 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.628 -0.67 . . . . 0.0 111.276 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -55.79 10.85 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 1.1 m -99.28 -49.53 4.43 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.419 -0.801 . . . . 0.0 112.67 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 8.7 tp 80.31 106.26 0.07 Allowed 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.884 0.849 . . . . 0.0 110.348 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 70.65 -68.26 0.22 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.64 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 3.3 m -144.47 179.66 7.12 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.356 0.598 . . . . 0.0 111.518 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.5 -162.32 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 11.1 t60 75.78 -59.81 0.51 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -61.96 -30.2 70.76 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.568 177.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.77 -32.59 70.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -35.09 68.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -69.45 -34.47 74.46 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.579 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.3 OUTLIER -58.74 -38.04 77.52 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.004 178.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.99 -37.01 73.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.648 0.737 . . . . 0.0 109.666 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.12 -38.99 60.88 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.643 0.735 . . . . 0.0 109.584 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.566 HG22 ' CD1' ' C' ' 781' ' ' ILE . 82.7 mt -59.06 -45.47 92.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.853 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 31.1 m -58.54 -44.11 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.313 -0.867 . . . . 0.0 111.42 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.419 ' O ' HG22 ' C' ' 782' ' ' VAL . 82.3 p -63.89 -46.19 85.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -31.76 72.11 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.133 0.492 . . . . 0.0 111.576 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.762 HG21 ' HB ' ' A' ' 746' ' ' ILE . 58.7 mt -63.89 -47.1 92.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 119.096 -0.478 . . . . 0.0 112.24 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.419 HG22 ' O ' ' C' ' 779' ' ' THR . 33.1 m -54.09 -37.89 36.46 Favored 'Isoleucine or valine' 0 C--N 1.35 0.625 0 CA-C-N 119.72 1.145 . . . . 0.0 110.047 -177.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -65.35 -46.38 80.45 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.413 0.625 . . . . 0.0 110.767 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 52.9 tp -70.52 -44.94 66.54 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.858 HD22 ' HA ' ' A' ' 744' ' ' ARG . 27.7 tp -88.08 -10.99 48.41 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.552 -0.717 . . . . 0.0 110.987 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.62 -33.48 4.66 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 121.8 -0.563 . . . . 0.0 111.988 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.26 107.41 14.38 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.995 -0.709 . . . . 0.0 109.486 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 117.921 -1.037 . . . . 0.0 110.734 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt -177.08 101.52 0.05 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.543 0.687 . . . . 0.0 109.676 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -173.65 -169.17 0.48 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.165 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 1.4 tt -48.02 -39.53 20.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.379 0.609 . . . . 0.0 110.821 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.48 -37.08 71.34 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -41.73 51.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.558 0.694 . . . . 0.0 110.739 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -75.15 -45.76 38.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.842 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.17 -35.28 76.13 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.021 0.439 . . . . 0.0 111.907 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.0 m -64.17 -31.03 72.07 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.526 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.418 HD23 HG23 ' A' ' 676' ' ' THR . 12.4 tp -63.42 -31.14 72.22 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.977 -0.452 . . . . 0.0 111.698 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -59.73 -29.84 68.41 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.778 -0.576 . . . . 0.0 111.08 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -25.57 68.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.183 0.516 . . . . 0.0 111.168 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -60.99 -40.54 93.86 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.59 0.71 . . . . 0.0 110.278 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 23.8 t80 56.34 35.01 25.15 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.559 0.695 . . . . 0.0 111.235 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -155.41 -64.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.714 -0.617 . . . . 0.0 111.649 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 679' ' ' LEU . 8.1 tp -68.22 -37.28 77.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 122.061 -0.399 . . . . 0.0 111.568 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.418 HG23 HD23 ' A' ' 669' ' ' LEU . 5.0 m -52.56 -33.69 46.91 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 122.095 -0.378 . . . . 0.0 111.727 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -65.88 -49.76 66.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.299 0.571 . . . . 0.0 110.686 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.4 t90 -65.26 -44.6 87.57 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.509 0.671 . . . . 0.0 109.352 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 675' ' ' ILE . 3.2 mm? -65.35 -35.61 81.48 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.964 -0.46 . . . . 0.0 111.729 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 5.1 t90 -93.28 -14.97 26.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.7 m-30 -93.37 -12.95 28.73 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.608 -0.682 . . . . 0.0 111.787 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.1 pp -60.79 -36.57 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 O-C-N 121.872 -0.517 . . . . 0.0 110.442 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.474 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.3 ttt-85 -53.77 -47.43 70.74 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.613 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.498 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -73.84 -35.12 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.421 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.4 OUTLIER -58.75 -27.78 65.26 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.612 -177.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.964 HG21 HD12 ' B' ' 686' ' ' ILE . 14.9 mm -60.88 -42.09 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 121.513 0.673 . . . . 0.0 109.247 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 77.2 mt -71.04 -36.75 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.072 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 684' ' ' ILE . 30.8 mm -58.6 -37.31 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 O-C-N 122.043 -0.411 . . . . 0.0 109.996 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 685' ' ' PHE . 98.8 t -54.44 -42.01 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.76 -41.51 66.46 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -65.92 -38.71 89.39 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.834 0.826 . . . . 0.0 109.714 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -45.86 91.16 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.947 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.808 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -67.76 -42.0 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.785 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.42 -24.57 61.74 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.563 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -60.47 -39.22 86.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 122.014 0.911 . . . . 0.0 109.459 178.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 17.6 mmt180 -56.22 -28.44 58.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.889 0.875 . . . . 0.0 112.812 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.1 -37.21 66.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 O-C-N 121.17 -0.956 . . . . 0.0 108.67 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.733 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.8 p -67.69 -30.65 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 O-C-N 121.533 -0.729 . . . . 0.0 110.239 176.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.89 -28.99 59.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.071 0.463 . . . . 0.0 110.405 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.47 -37.0 72.2 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.0 m -63.58 -35.99 74.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 119.938 -0.705 . . . . 0.0 109.552 178.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.8 tp -61.01 -42.3 98.2 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.013 -0.429 . . . . 0.0 110.753 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 60.9 p -62.94 -35.02 78.72 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.371 0.605 . . . . 0.0 110.072 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.44 96.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 122.113 0.958 . . . . 0.0 108.852 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 701' ' ' VAL . 98.6 t -65.39 -45.11 94.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.029 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -62.91 -36.82 84.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.914 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.425 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 8.3 ttm180 -60.59 -47.5 85.94 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.43 0.633 . . . . 0.0 110.612 -178.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 748' ' ' LEU . 1.2 t -75.02 -44.37 44.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 122.188 0.995 . . . . 0.0 108.58 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -66.11 -18.71 65.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.973 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -97.22 -18.82 19.0 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.384 -0.823 . . . . 0.0 112.841 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 116.66 11.27 9.53 Favored Glycine 0 CA--C 1.54 1.601 0 O-C-N 121.385 -0.822 . . . . 0.0 112.751 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.455 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 63.32 -121.08 0.56 Allowed 'General case' 0 CA--C 1.565 1.521 0 O-C-N 121.935 -0.744 . . . . 0.0 111.053 179.322 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.455 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 69.7 p -62.77 159.35 45.22 Favored Pre-proline 0 C--N 1.351 0.672 0 O-C-N 120.84 -1.163 . . . . 0.0 111.519 -178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.485 ' HD2' HG21 ' C' ' 708' ' ' VAL . 83.0 Cg_exo -43.67 113.72 0.43 Allowed 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 121.758 1.639 . . . . 0.0 111.758 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.12 -20.27 13.06 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.483 1.225 0 CA-C-O 122.669 1.223 . . . . 0.0 110.876 -179.037 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 122.18 0.99 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 12.4 mtt-85 -58.03 -25.47 61.2 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.759 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -10.8 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -176.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.502 ' O ' HD12 ' A' ' 746' ' ' ILE . 7.1 mtm105 -70.71 -46.18 63.56 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.45 -0.782 . . . . 0.0 109.196 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -59.07 -46.1 89.14 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.191 0.52 . . . . 0.0 111.962 -178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . 0.679 ' O ' HD22 ' C' ' 785' ' ' LEU . 0.5 OUTLIER -72.41 -28.61 63.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.57 0.7 . . . . 0.0 111.67 179.537 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 12.2 p -69.51 -36.46 76.47 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 121.011 -1.056 . . . . 0.0 111.726 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 749' ' ' VAL . 1.9 mp -66.61 -46.79 85.2 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 CA-C-O 117.058 -1.449 . . . . 0.0 114.0 -178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.717 ' CB ' HD23 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -80.45 -13.09 59.41 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 122.715 2.507 . . . . 0.0 109.453 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.631 HD13 ' HG3' ' B' ' 714' ' ' PRO . 56.5 tp -60.1 -17.23 38.4 Favored 'General case' 0 C--N 1.363 1.187 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 172.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.3 p -57.63 -44.82 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.432 ' ND2' HG12 ' A' ' 749' ' ' VAL . 5.9 m-80 -70.9 -13.19 61.93 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 122.116 0.96 . . . . 0.0 109.447 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.11 -18.95 21.66 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 124.167 0.889 . . . . 0.0 111.329 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 70.6 p -57.38 -37.3 72.45 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 117.645 0.722 . . . . 0.0 109.06 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.93 -51.05 69.67 Favored 'General case' 0 C--N 1.346 0.414 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.86 -35.25 72.66 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.892 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.3 -44.99 92.49 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.9 mt -61.71 -36.21 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -67.02 -30.56 70.68 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.625 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.533 ' OD1' HD22 ' B' ' 715' ' ' LEU . 13.2 m-20 -56.09 -50.15 71.83 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.407 -0.808 . . . . 0.0 109.154 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -71.49 -45.15 63.27 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.686 0.755 . . . . 0.0 111.624 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.457 ' O ' HD23 ' A' ' 760' ' ' LEU . 1.4 tt -61.53 -38.99 89.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.652 0.739 . . . . 0.0 112.359 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 13.5 ttm105 -82.59 -17.98 42.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 15.9 p -76.23 -46.16 29.48 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.481 -0.762 . . . . 0.0 112.706 -178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -68.6 -54.37 16.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.19 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 5.1 t -97.86 -49.51 4.78 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.039 0.923 . . . . 0.0 111.556 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 765' ' ' LEU . 7.9 tt 75.77 -71.3 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.298 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -108.4 -66.31 1.05 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.724 -0.61 . . . . 0.0 111.238 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 2.0 t -104.92 134.3 48.27 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.076 0.465 . . . . 0.0 110.476 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.451 ' CZ ' HD13 ' A' ' 771' ' ' LEU . 2.8 t80 -55.27 -21.63 15.25 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.981 0.419 . . . . 0.0 110.821 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -60.5 -39.92 89.46 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-O 121.726 0.774 . . . . 0.0 109.24 178.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -55.69 -29.5 59.52 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.837 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.501 HD11 HD22 ' A' ' 763' ' ' LEU . 9.2 tt -59.44 -34.77 72.92 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 122.157 -0.339 . . . . 0.0 110.606 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -56.88 -32.92 66.35 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -66.13 -46.84 76.13 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.572 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 763' ' ' LEU . 5.5 tp -58.91 -38.65 79.4 Favored 'General case' 0 C--N 1.354 0.782 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.441 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . 0.446 ' O ' HD23 ' A' ' 775' ' ' LEU . 7.5 tt -63.38 -42.6 98.83 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.692 -0.63 . . . . 0.0 111.791 -178.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 43.9 mt -74.57 -39.64 62.13 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.3 pp -68.71 -37.44 77.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.427 -178.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 18.4 m -60.4 -42.86 92.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.571 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.028 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.808 ' O ' HG22 ' A' ' 782' ' ' VAL . 24.2 p -63.79 -44.67 92.68 Favored 'General case' 0 C--N 1.343 0.303 0 O-C-N 122.042 -0.412 . . . . 0.0 111.768 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -33.69 76.13 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.44 ' HB ' HG21 ' B' ' 746' ' ' ILE . 60.6 mt -54.97 -37.1 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 O-C-N 121.911 -0.493 . . . . 0.0 110.663 -179.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 779' ' ' THR . 14.6 m -54.76 -38.15 42.78 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 O-C-N 121.209 -0.932 . . . . 0.0 109.69 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.16 -45.36 92.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.555 0.693 . . . . 0.0 110.753 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.89 -43.88 86.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.236 0.541 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.417 HD21 ' HG2' ' B' ' 747' ' ' ARG . 0.4 OUTLIER -74.62 -22.5 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.921 0.391 . . . . 0.0 111.509 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.07 -38.09 5.98 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -108.92 121.86 46.01 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.56 0.695 . . . . 0.0 110.485 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.593 -179.843 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.461 ' O ' HD22 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 120.457 0.17 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.461 HD22 ' O ' ' B' ' 660' ' ' LEU . 0.0 OUTLIER 176.53 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -176.01 -179.35 1.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.634 0.731 . . . . 0.0 110.924 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.51 HD12 ' HG ' ' C' ' 660' ' ' LEU . 0.5 OUTLIER -56.58 -39.05 72.84 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.498 0.666 . . . . 0.0 109.837 179.474 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.12 -34.22 77.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.344 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -75.22 -47.12 29.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.087 0.47 . . . . 0.0 110.379 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.424 ' HE1' HD12 ' B' ' 661' ' ' LEU . 82.6 m95 -68.24 -46.0 71.69 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.501 0.667 . . . . 0.0 111.439 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.64 -19.21 65.82 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.031 -0.532 . . . . 0.0 112.045 -178.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -29.8 66.24 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.063 -0.398 . . . . 0.0 111.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.443 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -60.78 -36.32 78.68 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -59.9 -17.26 35.83 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.846 -0.534 . . . . 0.0 111.239 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.13 -27.17 24.79 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.16 0.505 . . . . 0.0 110.205 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -64.04 -46.62 83.59 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.545 0.688 . . . . 0.0 110.431 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 21.0 t80 57.65 31.84 20.97 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.517 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -142.93 -70.41 0.33 Allowed 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.719 -0.613 . . . . 0.0 110.907 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -67.95 -37.5 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.05 -0.406 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.5 -33.87 46.92 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -65.67 -50.32 65.37 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.712 -0.617 . . . . 0.0 110.701 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.686 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.8 t90 -65.76 -42.45 90.88 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 122.017 0.913 . . . . 0.0 109.76 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.36 -39.17 93.8 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.14 -178.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -97.15 -28.2 14.22 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -77.11 -15.59 59.5 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.468 -0.77 . . . . 0.0 111.901 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.686 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.9 pt -60.78 -37.35 75.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.894 -0.504 . . . . 0.0 111.006 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -53.66 -47.35 70.45 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.912 0.387 . . . . 0.0 110.805 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.495 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -70.64 -35.17 59.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.97 -27.89 67.2 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.205 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.964 HD12 HG21 ' A' ' 686' ' ' ILE . 18.1 mm -60.62 -48.2 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 O-C-N 121.827 -0.546 . . . . 0.0 109.789 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -64.88 -41.1 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.99 -38.06 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.22 -44.3 98.94 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.18 -26.7 9.5 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 13.7 m -60.52 -46.11 91.37 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.541 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.82 -32.89 71.07 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.364 -0.835 . . . . 0.0 112.504 -177.558 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.541 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.3 OUTLIER -58.99 -47.02 91.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.96 -27.21 66.66 Favored Glycine 0 CA--C 1.541 1.699 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.565 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -59.33 -37.25 77.34 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.04 0.924 . . . . 0.0 110.089 179.455 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.808 ' HE ' HD11 ' A' ' 693' ' ' ILE . 12.8 mmt180 -55.39 -27.85 50.3 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -179.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.74 -36.86 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 O-C-N 121.028 -1.045 . . . . 0.0 109.01 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.565 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.6 p -67.41 -30.69 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 O-C-N 121.722 -0.611 . . . . 0.0 110.327 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.0 m-85 -56.49 -31.26 63.89 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.871 -0.518 . . . . 0.0 110.153 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -37.61 78.7 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -37.73 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.665 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.5 tp -56.86 -37.92 71.99 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.761 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 51.0 m -62.83 -36.15 82.25 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.18 0.514 . . . . 0.0 110.837 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -44.85 90.34 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 122.238 1.018 . . . . 0.0 108.826 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.691 HG22 HD13 ' B' ' 748' ' ' LEU . 76.9 t -65.36 -45.14 94.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 122.522 1.153 . . . . 0.0 109.211 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -62.69 -35.87 81.08 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.557 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -65.74 -49.41 68.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.488 0.661 . . . . 0.0 112.323 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -44.17 31.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.25 -45.35 91.43 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -175.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.43 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 2.4 pt20 -104.67 -24.56 12.94 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.67 177.31 14.84 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -113.43 -62.68 1.56 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.736 -0.861 . . . . 0.0 112.804 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 8.4 p -62.76 159.3 45.5 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.388 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.631 ' HG3' HD13 ' A' ' 748' ' ' LEU . 86.5 Cg_exo -29.81 108.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 122.76 2.307 . . . . 0.0 112.961 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.533 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.9 tt -67.02 -16.72 64.54 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 121.763 0.792 . . . . 0.0 109.547 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.488 0.661 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -58.6 -26.86 64.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.167 -178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -55.72 -12.28 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -68.41 -40.97 81.08 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.563 -0.711 . . . . 0.0 111.567 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -58.5 -41.14 84.69 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.506 -0.746 . . . . 0.0 110.664 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.26 -36.96 71.95 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.244 0.545 . . . . 0.0 110.021 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 8.9 p -56.96 -46.22 82.31 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 122.056 -0.402 . . . . 0.0 110.44 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.44 HG21 ' HB ' ' A' ' 781' ' ' ILE . 1.8 mp -53.34 -19.22 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.081 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.417 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.0 OUTLIER -59.39 -28.13 66.61 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.126 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.691 HD13 HG22 ' B' ' 705' ' ' VAL . 4.2 pp -55.61 -21.29 16.94 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.941 0.401 . . . . 0.0 110.374 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 48.4 t -55.61 -53.95 31.11 Favored 'Isoleucine or valine' 0 C--N 1.35 0.596 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.428 ' H ' HD22 ' B' ' 750' ' ' ASN . 3.5 m-80 -72.61 -22.66 60.93 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.689 174.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.23 -20.68 36.85 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.999 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 18.4 m -59.5 -38.97 82.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 117.884 0.842 . . . . 0.0 109.631 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 16.9 tp -67.89 -51.18 51.0 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.436 0.636 . . . . 0.0 109.995 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.55 81.0 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.3 0.571 . . . . 0.0 111.513 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.538 HD21 ' NE2' ' C' ' 710' ' ' GLN . 5.7 tt -60.81 -45.49 94.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.903 0.382 . . . . 0.0 111.618 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 54.8 mt -65.64 -37.32 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 121.654 0.74 . . . . 0.0 109.229 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.13 -30.06 68.24 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.673 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.509 ' OD1' HD22 ' C' ' 715' ' ' LEU . 82.7 m-20 -55.35 -46.91 76.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.531 -0.731 . . . . 0.0 109.767 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.36 -45.23 66.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-O 121.063 0.458 . . . . 0.0 112.166 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 43.4 mt -69.2 -45.35 70.13 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.475 0.655 . . . . 0.0 112.748 -178.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -60.86 -43.19 98.7 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.8 m -59.69 -42.97 94.16 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.413 -0.805 . . . . 0.0 111.323 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -68.0 -54.23 20.01 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 1.6 m -97.81 -48.11 5.32 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.653 0.739 . . . . 0.0 112.051 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 78.21 -54.74 0.49 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.654 0.782 . . . . 0.0 111.343 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -137.51 119.46 15.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 111.236 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 16.7 m 54.02 177.3 0.02 OUTLIER 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.147 0.499 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . 0.461 ' CD1' HD13 ' B' ' 771' ' ' LEU . 4.9 m-85 -97.49 -2.11 42.67 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.958 -0.464 . . . . 0.0 111.621 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -74.3 -43.15 57.99 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -62.24 -29.96 70.76 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.262 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' B' ' 768' ' ' TYR . 0.2 OUTLIER -59.79 -31.08 69.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -56.94 -35.61 69.28 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.466 0.651 . . . . 0.0 109.425 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -69.02 -34.93 76.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.311 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.502 HD13 ' HG ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.45 -37.95 76.51 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.023 0.439 . . . . 0.0 110.576 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.34 -36.54 73.58 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 0.0 111.65 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 15.0 mt -66.35 -48.09 71.37 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.775 -0.578 . . . . 0.0 111.623 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 17.4 pt -56.35 -34.94 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 O-C-N 122.004 -0.435 . . . . 0.0 110.4 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.432 ' HA ' HG12 ' B' ' 781' ' ' ILE . 56.2 t -53.44 -43.16 51.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -178.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.06 -36.49 84.18 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.75 0.786 . . . . 0.0 110.22 177.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -63.33 -36.43 83.65 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.155 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.968 HG23 HG23 ' C' ' 746' ' ' ILE . 3.7 mm -54.79 -55.45 15.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 O-C-N 122.11 -0.369 . . . . 0.0 110.933 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 31.3 m -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.39 0.614 . . . . 0.0 110.355 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.98 -42.05 99.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.196 0.522 . . . . 0.0 111.474 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 12.1 tp -68.66 -39.43 80.64 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.956 0.884 . . . . 0.0 110.226 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.727 HD13 HD21 ' C' ' 750' ' ' ASN . 0.8 OUTLIER -76.99 -23.0 52.29 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.459 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.58 -54.62 8.74 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.32 125.4 37.9 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.402 0.62 . . . . 0.0 110.323 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.632 -179.474 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.641 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.385 0.612 . . . . 0.0 110.016 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.517 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.1 mp 56.84 102.71 0.02 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 121.587 0.708 . . . . 0.0 110.585 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -164.13 171.07 15.57 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.717 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.466 HD23 ' C ' ' C' ' 663' ' ' LEU . 10.5 tt -51.93 -61.93 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.588 0.708 . . . . 0.0 110.853 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.81 -16.61 63.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.279 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -81.22 -46.15 15.25 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 122.06 -0.4 . . . . 0.0 111.194 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -64.84 -45.98 83.82 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.667 0.746 . . . . 0.0 110.013 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.32 -21.21 66.25 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.431 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 48.4 t -69.63 -29.69 67.24 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.884 -0.51 . . . . 0.0 111.483 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' C' ' 669' ' ' LEU . 4.4 mm? -59.85 -37.66 79.91 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.129 0.49 . . . . 0.0 110.795 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -59.87 -18.94 48.29 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 111.297 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -81.21 -28.33 34.94 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.425 0.631 . . . . 0.0 110.777 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -60.05 -46.51 89.3 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.586 0.708 . . . . 0.0 110.209 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.23 36.62 27.62 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.428 0.632 . . . . 0.0 111.66 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.6 -73.36 0.14 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.734 -0.604 . . . . 0.0 111.772 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.688 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.1 -37.33 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.366 0.603 . . . . 0.0 111.608 -178.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.76 -33.72 36.23 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.918 -0.488 . . . . 0.0 111.983 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -60.63 -50.19 74.52 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.721 -0.612 . . . . 0.0 109.665 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.5 t90 -65.67 -40.08 92.02 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 121.761 0.791 . . . . 0.0 109.815 178.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.548 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -65.44 -35.78 81.93 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -104.91 -20.52 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -176.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -86.97 -12.94 46.04 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.48 -0.763 . . . . 0.0 112.159 -179.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.1 pp -60.75 -36.35 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 122.033 -0.417 . . . . 0.0 110.329 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.499 ' N ' HD12 ' C' ' 682' ' ' ILE . 8.4 ttt-85 -53.9 -47.1 71.48 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.934 0.397 . . . . 0.0 110.467 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.445 HG22 HD12 ' C' ' 688' ' ' ILE . 1.7 mp -66.34 -36.35 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.676 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.8 -33.73 72.12 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.955 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.77 HG21 HD12 ' A' ' 686' ' ' ILE . 7.8 mm -60.95 -52.01 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.074 0.464 . . . . 0.0 110.083 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 61.3 mt -62.84 -37.07 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 121.709 0.766 . . . . 0.0 108.934 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.445 HD12 HG22 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -58.82 -37.57 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.676 HG23 ' O ' ' C' ' 685' ' ' PHE . 61.7 t -55.16 -40.03 53.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . 0.417 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.65 -39.49 75.86 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -67.66 -38.77 84.23 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.976 0.893 . . . . 0.0 109.384 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.26 -46.33 90.2 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.224 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.533 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.3 pp -65.27 -41.91 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 121.353 0.596 . . . . 0.0 109.848 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.556 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.76 -25.9 64.3 Favored Glycine 0 CA--C 1.539 1.588 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.42 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.4 tt -58.38 -37.8 75.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.723 0.773 . . . . 0.0 110.271 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -55.44 -28.71 56.02 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.556 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.79 -36.44 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 120.874 -1.141 . . . . 0.0 111.804 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.42 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -59.1 -30.39 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.271 -0.893 . . . . 0.0 110.19 178.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -56.41 -30.71 63.11 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.839 -0.538 . . . . 0.0 110.18 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.81 -37.78 77.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -68.36 -44.33 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.97 -36.95 75.7 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.72 178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 66.6 m -62.05 -37.26 84.29 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -40.91 95.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 122.0 0.905 . . . . 0.0 108.779 178.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.528 HG13 HD13 ' C' ' 748' ' ' LEU . 96.7 t -65.69 -44.98 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.693 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -62.79 -36.29 82.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.49 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -62.58 -48.69 78.33 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.8 0.81 . . . . 0.0 110.296 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.485 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -76.0 -43.96 38.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.978 -178.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . 0.414 ' HB2' HD22 ' C' ' 748' ' ' LEU . 4.5 tmm_? -73.07 -36.23 66.82 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.482 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.538 ' NE2' HD21 ' B' ' 755' ' ' LEU . 8.4 tt0 -102.48 -7.66 21.72 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 99.83 166.29 29.34 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -110.83 -63.0 1.45 Allowed 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.715 -0.874 . . . . 0.0 111.681 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 76.3 p -90.57 159.62 40.73 Favored Pre-proline 0 C--O 1.234 0.273 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.209 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_exo -38.93 119.32 0.43 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.561 1.508 . . . . 0.0 111.801 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.509 HD22 ' OD1' ' B' ' 758' ' ' ASP . 3.0 tt -96.47 4.52 52.05 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -175.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.928 0.87 . . . . 0.0 112.047 -179.449 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 . . . . . 0 C--O 1.234 0.274 0 CA-C-O 122.172 0.987 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -65.67 -26.71 67.91 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.584 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -55.98 -15.21 3.18 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.495 ' O ' HD12 ' C' ' 746' ' ' ILE . 45.6 mtm-85 -56.06 -33.45 65.02 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.82 -0.55 . . . . 0.0 110.8 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -58.28 -40.25 81.44 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.618 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -47.83 54.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.058 0.456 . . . . 0.0 110.455 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . 0.4 ' OG ' ' HA ' ' C' ' 742' ' ' ARG . 2.3 p -57.01 -34.88 68.6 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.968 HG23 HG23 ' B' ' 781' ' ' ILE . 0.3 OUTLIER -52.85 -23.23 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 O-C-N 121.658 -0.651 . . . . 0.0 109.856 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -60.18 -24.35 64.69 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.553 0.692 . . . . 0.0 110.069 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.528 HD13 HG13 ' C' ' 705' ' ' VAL . 3.0 pp -61.37 -26.34 67.77 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.904 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 82.3 t -55.81 -53.91 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.727 HD21 HD13 ' B' ' 785' ' ' LEU . 4.7 m-80 -72.69 -22.84 60.84 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.588 175.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -22.88 46.66 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.906 -177.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 38.1 t -61.2 -41.2 96.41 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.832 -0.805 . . . . 0.0 109.543 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.9 tp -68.12 -46.23 71.48 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 109.938 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.98 -35.56 81.1 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.689 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.483 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.2 tt -60.0 -45.43 92.76 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.268 0.556 . . . . 0.0 110.72 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 45.5 mm -67.43 -40.95 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.138 0.97 . . . . 0.0 108.723 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.44 -30.34 71.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.529 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -55.24 -44.0 75.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.552 -0.717 . . . . 0.0 110.892 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.13 -45.12 67.5 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.309 0.576 . . . . 0.0 110.891 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 26.9 mt -67.26 -40.22 86.2 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -67.29 -50.63 59.55 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 1.3 m -68.35 -43.3 77.74 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.228 1.013 . . . . 0.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.55 -52.68 56.41 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.96 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.79 -34.02 11.04 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.127 -0.983 . . . . 0.0 113.418 -177.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.03 177.25 0.24 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -38.14 -66.3 0.27 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 30.9 m -97.17 162.01 13.55 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.853 -0.529 . . . . 0.0 110.649 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -73.29 -29.7 62.9 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.839 0.352 . . . . 0.0 110.676 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 40.8 t60 -53.83 -32.04 51.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.815 0.817 . . . . 0.0 109.471 178.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 -69.91 -30.54 67.97 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.04 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.4 -43.39 96.73 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -56.78 -36.97 70.47 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.494 0.664 . . . . 0.0 109.428 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -69.17 -39.42 78.75 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.23 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.411 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -65.12 -38.11 89.61 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 121.087 0.47 . . . . 0.0 110.855 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.429 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.7 mp -58.4 -37.79 76.02 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.269 0.557 . . . . 0.0 110.256 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 57.4 mt -74.81 -36.72 62.45 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.486 0.66 . . . . 0.0 110.06 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.445 HG22 ' CD1' ' C' ' 781' ' ' ILE . 40.2 mt -61.26 -47.88 91.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.719 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.446 HG12 HG12 ' A' ' 746' ' ' ILE . 33.7 m -56.06 -39.33 57.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 O-C-N 121.641 -0.662 . . . . 0.0 111.182 -178.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.685 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.2 m -61.01 -47.95 84.08 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.402 -0.811 . . . . 0.0 110.978 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -68.23 -36.53 79.64 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.809 -0.557 . . . . 0.0 111.535 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.445 ' CD1' HG22 ' C' ' 777' ' ' ILE . 72.9 mt -54.93 -38.23 44.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 CA-C-O 118.644 -0.693 . . . . 0.0 111.954 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.685 HG22 ' O ' ' C' ' 779' ' ' THR . 14.2 m -53.2 -36.79 26.26 Favored 'Isoleucine or valine' 0 C--N 1.354 0.787 0 CA-C-N 120.169 1.35 . . . . 0.0 109.092 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -64.27 -41.62 96.83 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.344 -0.848 . . . . 0.0 110.688 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.94 -44.38 69.69 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.717 HD23 ' CB ' ' A' ' 747' ' ' ARG . 21.3 tp -79.53 -26.92 41.36 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.273 -0.892 . . . . 0.0 109.771 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -48.65 -33.7 12.96 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -102.48 129.21 48.93 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.255 0.55 . . . . 0.0 109.887 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.506 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.525 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 37.4 mt 61.46 113.23 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.598 0.713 . . . . 0.0 110.306 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -177.55 179.11 0.96 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.75 -41.81 67.51 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.365 0.603 . . . . 0.0 110.367 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -73.71 -32.87 64.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -78.01 -44.36 26.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.135 0.493 . . . . 0.0 111.199 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -65.04 -45.3 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.189 0.518 . . . . 0.0 110.475 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.35 -20.91 65.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.223 0.535 . . . . 0.0 111.362 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.8 t -65.17 -39.4 92.88 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.0 mm? -59.89 -27.69 66.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.039 0.447 . . . . 0.0 111.873 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.0 m95 -60.18 -24.6 64.9 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.822 -0.549 . . . . 0.0 112.132 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.61 -15.59 39.3 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.651 -0.655 . . . . 0.0 111.861 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -65.66 -45.98 80.89 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.497 0.665 . . . . 0.0 110.378 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 45.9 t80 58.42 42.49 21.16 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -161.02 -69.28 0.06 Allowed 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.653 -0.654 . . . . 0.0 111.733 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.33 -36.7 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 122.095 -0.378 . . . . 0.0 111.923 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 6.9 m -52.04 -34.5 43.6 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -65.83 -50.07 65.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.381 0.61 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -65.72 -44.13 86.99 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.698 0.761 . . . . 0.0 110.345 178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -36.0 82.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -95.51 -42.82 8.26 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -70.69 -3.71 19.9 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.557 -0.715 . . . . 0.0 112.755 -178.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.732 HD12 ' H ' ' A' ' 683' ' ' ARG . 1.1 pp -60.91 -36.66 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.672 -0.642 . . . . 0.0 110.038 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.732 ' H ' HD12 ' A' ' 682' ' ' ILE . 9.7 ttt-85 -56.99 -47.13 81.53 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.177 0.513 . . . . 0.0 110.478 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.462 ' O ' HD13 ' A' ' 688' ' ' ILE . 1.8 mp -70.59 -33.2 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -28.48 69.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.584 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 17.0 mm -60.95 -48.07 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.292 0.568 . . . . 0.0 109.656 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 80.1 mt -60.36 -36.94 72.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.462 HD13 ' O ' ' A' ' 684' ' ' ILE . 1.4 mp -60.09 -38.35 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 86.9 t -55.21 -40.86 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.88 -33.27 77.74 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -66.73 -38.71 87.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.95 0.881 . . . . 0.0 110.998 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -46.03 90.69 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -61.43 -41.65 90.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 O-C-N 121.716 -0.615 . . . . 0.0 109.764 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.22 -39.76 97.62 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 178.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.478 ' O ' HG12 ' A' ' 698' ' ' VAL . 4.3 tt -62.43 -40.37 96.35 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.869 0.842 . . . . 0.0 109.7 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.711 ' HE ' HD11 ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.95 -28.08 55.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.66 0.784 . . . . 0.0 112.188 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.9 -34.8 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.551 -0.718 . . . . 0.0 109.41 -177.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.761 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.1 p -53.81 -29.1 17.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 O-C-N 121.534 -0.729 . . . . 0.0 110.307 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -54.77 -28.68 50.53 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.808 -0.558 . . . . 0.0 110.504 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -36.57 70.19 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.3 m -61.29 -35.83 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 CA-C-O 121.674 0.75 . . . . 0.0 109.474 177.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -60.74 -41.95 96.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.11 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 56.3 p -62.48 -31.92 72.74 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.641 0.734 . . . . 0.0 109.679 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.512 HD22 HH12 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.48 -47.14 87.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.662 1.22 . . . . 0.0 108.667 177.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.415 ' CG2' HD12 ' A' ' 748' ' ' LEU . 80.7 t -64.63 -45.15 96.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.363 -1.289 . . . . 0.0 109.29 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . 0.53 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 7.8 m120 -62.31 -36.98 83.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.512 HH12 HD22 ' A' ' 704' ' ' LEU . 38.3 ttm105 -57.57 -48.46 79.29 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.725 -1.235 . . . . 0.0 110.083 -179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.5 t -76.42 -44.45 35.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.404 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.98 -16.03 61.08 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 1.8 tt0 -101.26 -8.45 22.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.031 -1.043 . . . . 0.0 113.468 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.38 18.1 10.68 Favored Glycine 0 CA--C 1.541 1.664 0 O-C-N 121.824 -0.548 . . . . 0.0 112.55 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.417 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.3 OUTLIER 54.13 -125.03 2.27 Favored 'General case' 0 CA--C 1.566 1.567 0 O-C-N 121.831 -0.805 . . . . 0.0 110.243 179.281 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.417 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 0.3 OUTLIER -62.13 159.71 36.4 Favored Pre-proline 0 C--N 1.353 0.734 0 O-C-N 120.754 -1.216 . . . . 0.0 109.689 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -45.4 104.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 121.177 1.251 . . . . 0.0 111.56 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.24 -20.33 16.65 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -177.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.549 0.909 0 CA-C-O 122.24 1.019 . . . . 0.0 111.052 -179.769 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.708 0.766 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -57.84 -25.28 60.47 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.001 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -12.33 0.68 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -177.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -42.26 89.18 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.479 -0.763 . . . . 0.0 109.021 177.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' C' ' 781' ' ' ILE . 19.5 m-20 -64.91 -36.1 83.27 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -36.67 77.05 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.69 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.5 p -63.76 -45.3 90.46 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.66 HD12 ' CD1' ' C' ' 781' ' ' ILE . 40.7 mt -55.32 -21.11 8.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.973 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.544 ' NH1' HG22 ' C' ' 781' ' ' ILE . 1.9 mmp_? -59.86 -30.48 69.0 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.629 -0.669 . . . . 0.0 109.201 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.837 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -62.07 -16.69 53.96 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.167 0.508 . . . . 0.0 110.315 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.57 -55.12 16.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.885 0 O-C-N 120.96 -1.088 . . . . 0.0 108.123 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.435 ' CG ' HD23 ' C' ' 785' ' ' LEU . 4.5 m-80 -72.96 -22.0 60.77 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 122.507 1.146 . . . . 0.0 108.953 174.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.45 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.72 -19.65 29.1 Favored Glycine 0 C--O 1.219 -0.843 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.211 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 88.3 p -57.98 -37.65 74.62 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.046 0.923 . . . . 0.0 109.065 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.2 tp -66.64 -51.1 60.02 Favored 'General case' 0 C--N 1.343 0.294 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.41 73.38 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.087 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.0 tt -58.67 -45.07 90.21 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.931 -0.481 . . . . 0.0 111.696 -176.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.73 -34.2 61.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.7 -29.48 66.9 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.941 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 20.2 m-20 -54.6 -49.02 71.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.324 -0.86 . . . . 0.0 109.686 -177.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.68 -44.93 65.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.527 0.679 . . . . 0.0 111.327 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 3.6 mt -65.74 -29.79 70.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 70.7 mtt180 -73.59 -27.79 61.48 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -45.74 39.43 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.368 -0.832 . . . . 0.0 110.446 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.706 ' HA ' HD22 ' A' ' 774' ' ' LEU . 6.3 mp -68.96 -54.94 12.62 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 -49.19 4.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.612 0.72 . . . . 0.0 111.785 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.422 ' C ' HD23 ' A' ' 765' ' ' LEU . 4.5 tt 79.21 -66.9 0.17 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.432 0.693 . . . . 0.0 110.988 -178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -112.64 -61.33 1.74 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.751 -0.593 . . . . 0.0 111.794 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 1.3 m -120.23 157.64 28.68 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.264 0.554 . . . . 0.0 110.732 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -21.16 66.06 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.769 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 65.0 m-70 -56.85 -42.0 78.94 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.307 1.051 . . . . 0.0 108.327 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -28.62 69.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.424 177.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.699 HD11 HD23 ' A' ' 763' ' ' LEU . 0.1 OUTLIER -58.5 -37.47 75.65 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.99 -32.89 72.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.21 -47.52 73.59 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 122.206 -0.309 . . . . 0.0 111.053 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 763' ' ' LEU . 6.1 tp -61.13 -37.8 84.12 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.977 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 25.6 mt -58.59 -36.41 73.96 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.83 -0.544 . . . . 0.0 112.045 -177.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 32.5 mt -74.55 -48.54 26.28 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.495 -0.753 . . . . 0.0 111.632 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.69 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.9 pp -70.69 -37.36 68.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 O-C-N 122.178 -0.326 . . . . 0.0 111.619 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.69 ' N ' HD12 ' A' ' 777' ' ' ILE . 9.8 p -58.71 -44.34 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 21.0 p -64.06 -35.56 81.15 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-O 122.223 1.011 . . . . 0.0 109.504 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -60.79 -45.42 94.45 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.481 HD12 ' HB ' ' B' ' 746' ' ' ILE . 2.7 pt -64.53 -41.94 93.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.108 -177.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 27.8 m -63.67 -38.6 82.69 Favored 'Isoleucine or valine' 0 C--N 1.346 0.451 0 CA-C-N 119.066 0.848 . . . . 0.0 111.025 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.41 -45.6 83.32 Favored 'General case' 0 C--N 1.35 0.588 0 O-C-N 121.715 -0.616 . . . . 0.0 111.031 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.42 ' O ' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -70.49 -40.21 73.72 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.382 -179.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 787' ' ' ARG . 3.6 tp -66.35 -38.16 86.99 Favored 'General case' 0 C--O 1.214 -0.792 0 O-C-N 122.06 -0.4 . . . . 0.0 110.861 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -12.97 61.15 0.0 OUTLIER Glycine 0 N--CA 1.483 1.799 0 C-N-CA 126.039 1.78 . . . . 0.0 115.251 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . 0.624 ' N ' ' O ' ' A' ' 785' ' ' LEU . 7.8 ptm180 -137.58 148.56 45.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.435 0.636 . . . . 0.0 111.279 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.933 -1.032 . . . . 0.0 110.472 179.599 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 54.74 96.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.554 0.692 . . . . 0.0 110.483 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -173.39 164.99 4.71 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.14 -37.64 67.22 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.471 0.653 . . . . 0.0 109.9 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -65.28 -36.92 85.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.699 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 10.9 tttm -80.63 -49.22 11.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.218 0.532 . . . . 0.0 110.125 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -56.53 -44.28 80.66 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.462 0.649 . . . . 0.0 110.029 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.66 -28.95 69.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.362 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 23.0 t -62.07 -36.82 82.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 111.242 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.467 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.8 mm? -59.78 -23.73 63.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 122.055 -0.403 . . . . 0.0 111.719 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -59.55 -29.0 67.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.32 0.581 . . . . 0.0 110.288 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.05 -7.71 56.62 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.212 0.53 . . . . 0.0 110.846 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . 0.44 ' O ' ' N ' ' B' ' 674' ' ' ASP . 14.4 m95 -94.54 34.64 1.29 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.333 0.587 . . . . 0.0 109.802 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -39.81 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 122.087 0.946 . . . . 0.0 113.35 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . 0.44 ' N ' ' O ' ' B' ' 672' ' ' TRP . 1.6 t70 177.7 -66.07 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.672 0.748 . . . . 0.0 110.134 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.69 -36.93 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.099 0.56 . . . . 0.0 112.022 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.4 m -51.6 -33.74 34.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -64.38 -50.02 69.33 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 121.744 -0.597 . . . . 0.0 109.884 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.633 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.64 -43.05 90.64 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.748 0.785 . . . . 0.0 109.52 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.72 80.96 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 15.4 t90 -100.48 -45.9 5.4 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -63.55 -7.21 6.47 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.594 -0.691 . . . . 0.0 112.398 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' B' ' 683' ' ' ARG . 1.8 pp -60.44 -36.43 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 O-C-N 121.652 -0.655 . . . . 0.0 110.418 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' B' ' 682' ' ' ILE . 8.2 ttt-85 -53.7 -47.35 70.59 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.048 -0.408 . . . . 0.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.482 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.1 mp -69.01 -36.05 71.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -31.41 69.75 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.607 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.763 HD12 HG21 ' A' ' 686' ' ' ILE . 14.1 mm -60.68 -46.56 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.74 -41.45 92.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.29 -37.74 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' B' ' 692' ' ' LEU . 53.5 t -59.11 -40.12 80.15 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.89 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.23 -27.22 67.16 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.752 -0.592 . . . . 0.0 111.822 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.0 m -60.66 -41.43 95.0 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -177.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.646 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.3 -33.2 70.8 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 121.486 -0.759 . . . . 0.0 112.372 -176.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.776 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -66.27 -40.38 86.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 121.453 -0.779 . . . . 0.0 109.896 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.504 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.89 -33.94 85.4 Favored Glycine 0 CA--C 1.543 1.807 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.415 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.9 tt -69.81 -37.22 76.18 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.866 0.841 . . . . 0.0 110.323 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.46 ' HE ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -55.08 -27.5 45.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.447 1.099 . . . . 0.0 113.832 -178.574 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.504 HG22 ' O ' ' B' ' 694' ' ' GLY . 20.8 tt -57.71 -34.86 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.26 -0.9 . . . . 0.0 109.704 -177.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.415 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.2 p -53.52 -28.93 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 O-C-N 121.603 -0.686 . . . . 0.0 110.002 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -55.39 -30.7 60.89 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.612 -0.68 . . . . 0.0 109.993 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.77 78.0 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.5 -41.13 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.78 -37.78 80.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.303 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 44.1 p -62.47 -41.69 98.95 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.57 -178.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.85 -40.58 89.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 121.677 0.751 . . . . 0.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.34 -43.61 87.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -62.72 -36.58 83.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.348 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -65.65 -49.39 68.82 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.703 1.239 . . . . 0.0 109.49 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD11 ' B' ' 748' ' ' LEU . 9.4 t -77.4 -45.37 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -176.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -63.91 -44.81 91.83 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -174.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 7.9 pt20 -104.59 -24.14 13.03 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.95 165.11 10.13 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . 0.487 ' O ' HD11 ' A' ' 704' ' ' LEU . 24.5 p90 -106.7 -57.28 2.08 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.195 -0.591 . . . . 0.0 112.166 -179.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 65.7 p -74.83 159.16 83.68 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.313 -0.851 . . . . 0.0 108.792 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -32.89 124.5 0.11 Allowed 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.238 1.959 . . . . 0.0 112.376 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.431 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.6 tt -79.09 -14.93 58.84 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 121.945 0.878 . . . . 0.0 112.538 -178.798 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.628 0 CA-C-O 121.39 0.614 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -71.34 -26.5 62.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.105 0.479 . . . . 0.0 111.259 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.5 -10.58 0.67 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -56.13 -30.73 62.54 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.365 -0.834 . . . . 0.0 110.311 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -61.49 -41.66 97.6 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -37.17 72.21 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.567 178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . 0.495 ' O ' HD12 ' B' ' 748' ' ' LEU . 63.2 p -56.93 -36.0 69.73 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.481 ' HB ' HD12 ' A' ' 781' ' ' ILE . 1.2 mp -55.34 -18.3 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.405 HH11 HD11 ' A' ' 785' ' ' LEU . 14.9 ttm180 -59.48 -28.13 66.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.664 HD11 HG11 ' B' ' 708' ' ' VAL . 0.3 OUTLIER -55.54 -21.75 18.45 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.094 0.474 . . . . 0.0 109.856 177.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . 0.419 HG23 ' O ' ' B' ' 746' ' ' ILE . 54.1 t -55.84 -54.19 29.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 106.746 -1.575 . . . . 0.0 106.746 178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.518 ' ND2' HD23 ' A' ' 785' ' ' LEU . 4.0 m-80 -72.94 -24.48 60.81 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.436 174.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.08 33.57 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.77 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.68 -37.94 77.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.001 0.901 . . . . 0.0 108.948 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 17.2 tp -68.78 -49.4 58.95 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.4 0.619 . . . . 0.0 109.762 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.41 80.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.248 0.547 . . . . 0.0 112.359 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.4 tt -60.24 -45.53 92.93 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.425 0.631 . . . . 0.0 110.882 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.73 -39.29 85.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 122.004 0.907 . . . . 0.0 108.653 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.44 68.62 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.082 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 85.7 m-20 -55.15 -49.07 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.456 -0.777 . . . . 0.0 110.963 -177.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -70.3 -40.86 73.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.109 0.481 . . . . 0.0 110.809 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 19.1 mt -69.15 -31.06 69.47 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -68.6 -49.75 56.91 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.828 -0.545 . . . . 0.0 112.271 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 4.0 m -69.18 -41.07 77.65 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.743 0.782 . . . . 0.0 110.921 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.545 ' HA ' HD22 ' B' ' 774' ' ' LEU . 2.2 tp -59.99 -53.31 59.31 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.471 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . 0.425 ' HB2' HD12 ' B' ' 771' ' ' LEU . 23.1 t -97.35 -10.74 25.02 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.526 -0.734 . . . . 0.0 112.966 -178.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 3.6 mt 68.7 -73.47 0.09 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -138.76 -77.23 0.36 Allowed 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.864 -0.523 . . . . 0.0 110.08 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m -79.73 148.78 31.38 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.853 -0.529 . . . . 0.0 110.125 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -37.38 82.89 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.099 0.476 . . . . 0.0 110.122 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -54.46 -39.62 67.64 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.682 0.753 . . . . 0.0 109.494 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 3.3 tpp85 -59.49 -30.07 68.3 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.038 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 771' ' ' LEU . 3.8 tt -60.11 -38.41 82.91 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -40.52 85.19 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.23 -43.86 93.62 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' B' ' 763' ' ' LEU . 0.4 OUTLIER -59.51 -36.91 77.0 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 121.694 0.759 . . . . 0.0 110.539 178.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 mt -56.85 -35.98 69.5 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.481 -0.762 . . . . 0.0 109.846 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . 0.45 ' O ' HG22 ' B' ' 779' ' ' THR . 70.8 mt -64.58 -37.65 88.28 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.85 -0.531 . . . . 0.0 110.797 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 9.9 pt -69.64 -35.49 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 O-C-N 121.63 -0.669 . . . . 0.0 109.393 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.407 ' HA ' HG12 ' B' ' 781' ' ' ILE . 72.6 t -54.04 -46.21 65.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 776' ' ' LEU . 4.8 t -64.02 -34.84 78.91 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.224 -0.922 . . . . 0.0 109.824 176.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -31.23 70.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 121.278 0.561 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.752 HD12 HG13 ' C' ' 746' ' ' ILE . 39.3 mm -54.35 -55.37 15.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 123.225 0.61 . . . . 0.0 110.571 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.39 -38.75 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-O 121.655 0.741 . . . . 0.0 110.875 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.88 -41.87 95.27 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.745 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.37 -43.9 69.18 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.324 0.583 . . . . 0.0 111.285 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.844 HD23 ' ND2' ' C' ' 750' ' ' ASN . 5.4 tp -87.37 -9.37 55.0 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.63 -38.62 82.68 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.96 109.92 19.1 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 122.286 -0.538 . . . . 0.0 110.084 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.22 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.506 ' N ' HD23 ' C' ' 660' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.937 0 CA-C-O 120.419 0.152 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.409 HD22 ' CZ2' ' C' ' 666' ' ' TRP . 36.4 mt 56.04 99.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.48 0.657 . . . . 0.0 110.546 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.77 168.04 12.69 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.325 0.583 . . . . 0.0 110.236 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.525 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.3 tm? -43.58 -51.74 6.7 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.451 0.643 . . . . 0.0 112.232 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.481 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -71.9 -28.0 63.21 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -81.32 -32.27 33.15 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 122.05 -0.406 . . . . 0.0 111.496 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.409 ' CZ2' HD22 ' C' ' 661' ' ' LEU . 76.0 m95 -68.75 -46.35 69.05 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.236 0.541 . . . . 0.0 110.38 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.04 84.64 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.992 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -26.04 67.78 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.398 0.618 . . . . 0.0 110.63 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -34.37 74.21 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.16 0.505 . . . . 0.0 110.898 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -75.59 -14.57 60.39 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 122.13 -0.356 . . . . 0.0 111.749 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.64 -33.78 75.65 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.587 0.708 . . . . 0.0 110.334 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m0 -55.99 -40.09 72.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.595 0.712 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 32.3 t80 57.54 43.25 23.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.78 0.8 . . . . 0.0 111.398 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -159.69 -65.52 0.07 Allowed 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.62 -0.675 . . . . 0.0 112.016 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.74 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -67.6 -38.24 80.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 121.444 0.64 . . . . 0.0 111.432 -178.593 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.2 m -52.94 -33.79 52.46 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -62.11 -50.05 73.46 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.817 -0.552 . . . . 0.0 111.69 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.656 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -65.41 -44.23 88.07 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.431 0.634 . . . . 0.0 109.389 178.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.523 ' O ' HD23 ' C' ' 679' ' ' LEU . 1.1 tt -64.28 -35.78 81.95 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.069 -178.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -95.93 -20.51 18.7 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -86.72 -19.18 29.54 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.714 -0.616 . . . . 0.0 111.648 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.656 HG23 ' O ' ' C' ' 678' ' ' TRP . 7.6 pt -60.66 -36.8 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 O-C-N 121.836 -0.54 . . . . 0.0 110.321 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -55.02 -47.15 75.11 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.172 0.51 . . . . 0.0 110.036 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.401 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -67.8 -33.87 64.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.52 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -60.17 -29.78 68.9 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.859 179.643 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 8.0 mm -64.42 -47.4 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.305 0.574 . . . . 0.0 109.708 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.3 mt -64.74 -39.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.92 -37.71 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.458 HG23 ' O ' ' C' ' 685' ' ' PHE . 56.0 t -54.8 -40.91 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -53.61 -41.32 64.79 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 109.005 -1.638 . . . . 0.0 109.005 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.0 m -66.73 -38.5 86.81 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.864 0.84 . . . . 0.0 109.497 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.35 -43.7 92.77 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.171 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.711 HD11 ' HE ' ' A' ' 696' ' ' ARG . 0.1 OUTLIER -68.5 -42.23 83.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.476 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.58 -34.14 84.75 Favored Glycine 0 CA--C 1.535 1.338 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.82 -36.93 63.04 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.322 1.058 . . . . 0.0 110.173 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.776 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.9 mmt180 -55.62 -28.59 56.1 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -177.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.476 HG22 ' O ' ' C' ' 694' ' ' GLY . 6.8 tp -59.27 -36.59 64.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 O-C-N 121.076 -1.015 . . . . 0.0 112.083 -175.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.8 p -56.51 -30.74 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.294 -0.879 . . . . 0.0 110.439 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -58.59 -31.75 68.33 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.8 -45.45 92.29 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.484 ' O ' HG23 ' C' ' 705' ' ' VAL . 1.8 t -65.93 -39.31 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.643 177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.75 -37.68 87.53 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.78 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 3.6 m -68.37 -37.81 80.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.219 0.533 . . . . 0.0 110.596 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.39 -40.83 93.95 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.873 0.844 . . . . 0.0 108.955 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.484 HG23 ' O ' ' C' ' 701' ' ' VAL . 71.6 t -67.63 -45.57 84.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.981 0.896 . . . . 0.0 108.947 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 2.3 m120 -63.15 -36.49 83.78 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.418 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -49.57 74.16 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.551 0.691 . . . . 0.0 111.119 -177.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 4.2 p -77.19 -41.93 30.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.599 0.714 . . . . 0.0 112.453 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.7 -40.22 63.78 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' B' ' 758' ' ' ASP . 0.1 OUTLIER -101.93 -21.34 14.55 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -175.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 131.08 170.93 12.78 Favored Glycine 0 N--CA 1.474 1.169 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -131.79 -53.93 1.0 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.03 -0.688 . . . . 0.0 111.86 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.484 ' HA ' HG21 ' B' ' 708' ' ' VAL . 51.5 p -90.35 152.26 45.39 Favored Pre-proline 0 C--O 1.232 0.144 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.748 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -35.89 98.59 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.397 2.064 . . . . 0.0 111.63 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.3 16.21 0.64 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -176.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.472 0.651 0 CA-C-O 121.794 0.807 . . . . 0.0 110.017 178.856 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 122.271 1.034 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -62.32 -26.36 68.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.958 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.03 -19.31 6.7 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.754 -0.591 . . . . 0.0 111.815 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.482 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.4 mtm105 -66.25 -32.84 74.5 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.246 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.55 -37.28 72.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -71.28 -36.57 71.73 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.858 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 10.1 p -56.82 -25.29 55.59 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.13 -0.356 . . . . 0.0 110.522 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.752 HG13 HD12 ' B' ' 781' ' ' ILE . 0.7 OUTLIER -52.79 -32.42 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -23.3 62.85 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.265 0.555 . . . . 0.0 111.648 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 7.7 tt -72.19 -33.94 68.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.006 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.73 -54.03 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.8 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.844 ' ND2' HD23 ' B' ' 785' ' ' LEU . 6.9 m-80 -72.47 -13.89 61.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.759 0.79 . . . . 0.0 110.012 174.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.78 -20.83 41.66 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 121.973 -0.454 . . . . 0.0 112.71 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 2.4 m -58.85 -40.99 85.93 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 117.751 0.776 . . . . 0.0 109.839 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -68.59 -48.17 64.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.608 0.718 . . . . 0.0 109.557 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.1 -35.3 73.18 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.213 0.53 . . . . 0.0 111.291 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.53 ' C ' HD23 ' C' ' 755' ' ' LEU . 8.5 tt -59.65 -45.04 93.22 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.457 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 49.8 mt -67.13 -40.69 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.337 0.589 . . . . 0.0 109.818 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.26 -32.37 71.53 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.75 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -59.07 -39.26 81.55 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.533 -0.729 . . . . 0.0 109.124 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.41 -45.6 65.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.65 0.738 . . . . 0.0 111.509 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.41 -41.66 76.11 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.319 0.581 . . . . 0.0 112.564 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.41 -41.51 69.48 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.6 p -64.47 -45.48 87.19 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.427 HD22 HD11 ' C' ' 771' ' ' LEU . 0.2 OUTLIER -69.24 -55.0 11.84 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.683 -179.823 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.532 ' OG ' HD12 ' C' ' 771' ' ' LEU . 2.3 m -98.85 -43.46 6.74 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' C' ' 764' ' ' SER . 60.2 tp 85.71 -62.97 0.06 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.128 0.971 . . . . 0.0 110.36 -176.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.2 -74.13 0.46 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.486 -0.759 . . . . 0.0 111.887 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 68.2 m -106.58 159.47 16.16 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.734 -0.603 . . . . 0.0 111.125 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.35 -28.2 67.98 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 110.267 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -60.16 -40.6 90.48 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -30.74 69.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.286 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' OG ' ' C' ' 764' ' ' SER . 9.6 tt -60.3 -30.88 69.77 Favored 'General case' 0 C--N 1.344 0.366 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -39.27 73.93 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -65.51 -36.13 82.91 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.846 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.616 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -58.72 -37.91 77.18 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 121.489 0.662 . . . . 0.0 109.817 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.414 ' O ' HG22 ' C' ' 778' ' ' VAL . 5.8 tp -57.45 -36.41 71.38 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.553 0.692 . . . . 0.0 109.431 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -36.14 64.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.405 0.621 . . . . 0.0 109.677 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 16.0 mt -62.07 -43.46 97.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.724 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.545 ' HA ' HD13 ' A' ' 746' ' ' ILE . 5.0 m -63.52 -45.92 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.917 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.491 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.4 p -64.11 -43.25 95.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.338 0.59 . . . . 0.0 112.109 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -32.15 72.78 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.021 -0.424 . . . . 0.0 112.075 -178.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.66 ' CD1' HD12 ' A' ' 746' ' ' ILE . 79.5 mt -69.46 -43.78 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 O-C-N 121.801 -0.562 . . . . 0.0 111.607 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.491 HG22 ' O ' ' C' ' 779' ' ' THR . 26.8 m -56.06 -38.09 51.76 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 O-C-N 121.361 -0.837 . . . . 0.0 111.426 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -56.77 -41.88 78.41 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.435 -0.791 . . . . 0.0 111.331 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 59.7 tp -59.56 -42.62 92.81 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.046 0.45 . . . . 0.0 110.829 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 747' ' ' ARG . 7.9 tp -80.56 -25.76 38.4 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.207 0.527 . . . . 0.0 110.88 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -40.61 -40.03 1.97 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 111.816 -0.514 . . . . 0.0 111.816 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 115.21 13.18 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.71 0.767 . . . . 0.0 110.123 178.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.912 -1.042 . . . . 0.0 110.293 -179.7 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.455 HD13 ' CD2' ' C' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 mt 55.62 92.94 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.538 0.685 . . . . 0.0 110.341 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -175.03 169.54 3.34 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.549 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.3 tt -50.85 -40.05 55.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -68.58 -36.28 78.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.407 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.6 tppt? -81.13 -42.64 20.6 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.29 0.567 . . . . 0.0 110.343 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.0 m95 -64.34 -46.31 84.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.07 0.462 . . . . 0.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.96 76.75 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.42 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.4 m -59.72 -33.1 71.19 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.276 0.56 . . . . 0.0 110.833 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.408 HD23 HG23 ' A' ' 676' ' ' THR . 2.7 tp -60.53 -29.82 69.36 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.019 0.438 . . . . 0.0 111.092 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -60.67 -20.71 61.63 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.796 -0.565 . . . . 0.0 111.881 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -81.96 -23.99 35.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.08 0.467 . . . . 0.0 111.287 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -58.12 -43.43 87.22 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.496 0.665 . . . . 0.0 110.609 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.7 t80 56.78 37.5 28.85 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.45 0.643 . . . . 0.0 111.796 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.42 -68.23 0.08 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.633 -0.667 . . . . 0.0 112.026 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.653 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.87 -37.14 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 CA-C-O 121.533 0.683 . . . . 0.0 111.532 -178.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.408 HG23 HD23 ' A' ' 669' ' ' LEU . 9.1 m -51.88 -33.73 37.91 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -62.73 -49.68 74.08 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.338 0.589 . . . . 0.0 109.8 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.814 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.9 t90 -65.07 -43.96 90.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.633 0.73 . . . . 0.0 109.553 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -35.41 80.14 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.003 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -99.92 -12.47 19.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -100.61 -1.3 35.73 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.475 -0.766 . . . . 0.0 111.814 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 678' ' ' TRP . 7.9 pt -64.25 -36.75 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 O-C-N 121.918 -0.488 . . . . 0.0 110.822 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -47.28 69.84 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.376 0.608 . . . . 0.0 110.114 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.449 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.8 mp -66.66 -26.18 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 177.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.493 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -74.1 -32.4 63.2 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.038 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.66 HG21 HD12 ' B' ' 686' ' ' ILE . 20.1 mm -60.67 -48.74 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 121.153 0.501 . . . . 0.0 110.476 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 72.5 mt -67.19 -36.63 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 121.379 0.609 . . . . 0.0 109.669 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mt -58.69 -37.82 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.72 -41.38 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . 0.402 ' O ' HG13 ' A' ' 693' ' ' ILE . . . -58.03 -33.92 70.81 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -67.35 -38.29 84.59 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.886 0.85 . . . . 0.0 110.514 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.474 HD23 HD11 ' C' ' 693' ' ' ILE . 0.3 OUTLIER -59.26 -42.01 90.16 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.463 -177.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.427 ' CD1' HD13 ' B' ' 692' ' ' LEU . 1.9 pp -64.95 -41.6 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.589 -0.695 . . . . 0.0 110.386 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.41 -18.36 50.2 Favored Glycine 0 CA--C 1.541 1.703 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.03 -38.24 87.9 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.789 0.804 . . . . 0.0 109.562 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.458 ' HD2' ' N ' ' A' ' 696' ' ' ARG . 7.7 mpt_? -55.58 -28.71 56.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.585 0.754 . . . . 0.0 111.963 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.4 -41.59 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 O-C-N 121.472 -0.767 . . . . 0.0 109.094 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.737 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -67.51 -30.25 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.251 -0.906 . . . . 0.0 110.078 177.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.39 -28.65 55.4 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.588 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.1 72.25 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.5 m -60.97 -37.4 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 121.684 -0.635 . . . . 0.0 109.74 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.1 tp -62.02 -44.02 97.6 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.128 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 2.1 p -62.69 -32.53 73.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.898 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.562 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.2 OUTLIER -63.28 -43.82 96.83 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.385 1.088 . . . . 0.0 108.585 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.474 HG22 HD12 ' A' ' 748' ' ' LEU . 93.4 t -66.68 -41.92 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.431 178.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.29 -39.08 91.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.063 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -61.66 -48.68 79.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.104 0.954 . . . . 0.0 111.04 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.417 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -71.71 -44.39 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 122.29 1.043 . . . . 0.0 109.655 -179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -68.24 -20.57 64.82 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.871 -178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -97.11 -21.61 17.25 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.03 -1.044 . . . . 0.0 113.744 -177.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.06 69.98 0.72 Allowed Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.704 -0.622 . . . . 0.0 114.291 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 33.1 -134.73 0.03 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.416 ' CB ' HG21 ' C' ' 708' ' ' VAL . 97.3 p -62.81 159.33 45.75 Favored Pre-proline 0 C--N 1.353 0.752 0 O-C-N 121.166 -0.959 . . . . 0.0 112.01 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.72 105.74 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.189 0 C-N-CA 121.254 1.303 . . . . 0.0 111.504 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.7 pt? -101.34 -20.3 15.26 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.4 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 2.1 t . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 122.116 0.96 . . . . 0.0 109.41 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 122.157 0.98 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -57.93 -25.33 60.76 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.536 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -6.84 0.13 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -177.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 746' ' ' ILE . 9.9 ttm180 -59.71 -45.56 91.78 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.516 ' HA ' HD13 ' C' ' 781' ' ' ILE . 2.4 p30 -59.78 -32.13 70.32 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.662 0.744 . . . . 0.0 109.633 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . 0.754 ' HD3' HD13 ' C' ' 785' ' ' LEU . 20.1 mmt85 -71.07 -46.09 62.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 121.487 -0.758 . . . . 0.0 111.075 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 97.3 p -58.27 -31.62 67.61 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.493 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.577 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -65.93 -47.26 85.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 116.918 -1.515 . . . . 0.0 113.726 -179.2 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.751 ' HB3' HD23 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -86.78 -16.66 35.62 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 122.508 2.413 . . . . 0.0 108.597 178.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 748' ' ' LEU . 0.6 OUTLIER -56.03 -18.82 10.5 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 172.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.544 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 0.4 OUTLIER -55.83 -50.37 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 174.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.481 ' ND2' HG12 ' A' ' 749' ' ' VAL . 3.7 m-80 -71.19 -23.1 61.97 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 122.584 1.183 . . . . 0.0 107.965 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -56.19 -18.33 20.28 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.401 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.5 p -56.49 -36.26 68.93 Favored 'General case' 0 C--N 1.344 0.361 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 29.5 tp -61.15 -47.85 84.29 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 176.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.76 -35.18 74.08 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.427 HD22 HG12 ' A' ' 701' ' ' VAL . 8.9 tt -59.7 -45.3 92.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.453 0.644 . . . . 0.0 110.492 -178.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.9 mm -61.62 -33.18 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.31 -30.65 69.69 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.731 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.719 ' CG ' HD13 ' B' ' 715' ' ' LEU . 1.7 m-20 -55.44 -43.43 75.4 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.279 -0.888 . . . . 0.0 109.654 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -70.14 -44.76 68.21 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.315 0.578 . . . . 0.0 111.034 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.83 -35.66 81.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.279 0.561 . . . . 0.0 111.737 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.56 -35.22 65.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.943 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 13.1 t -69.64 -45.58 68.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.446 0.641 . . . . 0.0 111.094 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.726 ' HA ' HD13 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -68.76 -55.16 12.17 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -179.472 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . 0.428 ' HB3' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -98.91 -49.68 4.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.537 0.684 . . . . 0.0 112.771 -179.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 12.0 tp 74.18 -62.2 0.47 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -137.96 134.86 35.42 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 58.67 174.51 0.07 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.07 0.462 . . . . 0.0 110.056 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -98.87 -27.04 14.09 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.042 -0.411 . . . . 0.0 111.266 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -52.94 -49.59 65.73 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.586 0.708 . . . . 0.0 110.493 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -56.55 -28.01 59.08 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.279 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.436 HD13 ' CE1' ' A' ' 768' ' ' TYR . 0.9 OUTLIER -57.62 -30.77 65.62 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.794 -0.566 . . . . 0.0 110.514 -176.371 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -62.4 -31.84 72.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.521 0.676 . . . . 0.0 109.291 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.33 -47.82 84.38 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.793 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.726 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.6 tt -58.89 -42.13 88.83 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.548 -179.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.16 -40.13 84.65 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.879 -0.513 . . . . 0.0 112.306 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . 0.434 ' O ' HG22 ' A' ' 779' ' ' THR . 60.6 mt -72.03 -37.73 69.67 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.39 -36.67 73.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.71 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.24 -46.38 77.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -63.82 -35.44 80.61 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.763 0.792 . . . . 0.0 110.293 178.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 23.7 tpt85 -67.09 -43.39 82.69 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 60.8 mt -63.59 -41.13 91.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.312 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 779' ' ' THR . 3.5 m -61.44 -38.67 80.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 121.499 -0.75 . . . . 0.0 110.272 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -61.25 -49.65 76.24 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 111.092 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.14 -44.12 69.53 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.202 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.414 HD23 ' ND2' ' B' ' 750' ' ' ASN . 0.3 OUTLIER -73.76 -17.01 61.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.862 0.363 . . . . 0.0 111.826 -179.04 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -77.45 52.01 3.39 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -137.11 150.69 48.16 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 122.201 -0.588 . . . . 0.0 110.901 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.348 179.437 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.679 ' HG ' HD22 ' B' ' 661' ' ' LEU . 4.3 tp . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.679 HD22 ' HG ' ' B' ' 660' ' ' LEU . 1.3 mm? 52.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.954 0.883 . . . . 0.0 111.056 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -171.43 -176.68 1.9 Allowed 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.469 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.618 HD12 HD13 ' C' ' 660' ' ' LEU . 0.7 OUTLIER -53.52 -43.84 68.67 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.812 0.815 . . . . 0.0 110.105 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -71.69 -31.48 66.82 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.355 -0.838 . . . . 0.0 112.537 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -44.94 21.2 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.316 0.579 . . . . 0.0 110.918 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -70.62 -42.1 71.38 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.369 0.604 . . . . 0.0 110.654 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.04 -20.92 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.33 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 22.0 p -65.47 -35.2 80.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.221 0.534 . . . . 0.0 110.962 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.42 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.0 mm? -59.67 -31.46 69.57 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.272 0.558 . . . . 0.0 110.931 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -59.88 -24.46 64.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.096 0.474 . . . . 0.0 111.201 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -84.57 -27.72 27.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.264 0.554 . . . . 0.0 111.189 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -60.73 -53.15 60.91 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.482 0.658 . . . . 0.0 110.67 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.51 41.69 7.19 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.775 0.797 . . . . 0.0 111.538 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -156.68 -63.34 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.631 -0.668 . . . . 0.0 111.371 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.634 HG13 HD23 ' B' ' 679' ' ' LEU . 7.1 tp -68.42 -37.33 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.803 -0.561 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.7 m -52.36 -33.64 43.95 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.141 -0.349 . . . . 0.0 111.501 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . 0.404 ' OD1' ' CZ ' ' B' ' 681' ' ' TYR . 43.0 m-20 -62.12 -49.21 76.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.292 0.568 . . . . 0.0 110.166 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.645 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.6 t90 -65.62 -44.24 87.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 121.749 0.785 . . . . 0.0 109.814 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.634 HD23 HG13 ' B' ' 675' ' ' ILE . 3.7 mm? -64.78 -35.29 80.62 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -94.39 -34.81 12.62 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . 0.404 ' CZ ' ' OD1' ' B' ' 677' ' ' ASN . 20.7 m-30 -71.2 -20.95 62.21 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.928 -0.483 . . . . 0.0 111.77 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.775 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.6 -36.43 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 121.9 -0.5 . . . . 0.0 110.224 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . 0.775 ' N ' HD12 ' B' ' 682' ' ' ILE . 9.3 ttt-85 -54.52 -47.47 73.07 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.015 0.436 . . . . 0.0 110.875 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.438 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -69.04 -37.16 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.463 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.0 -30.43 69.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.427 -179.091 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.66 HD12 HG21 ' A' ' 686' ' ' ILE . 13.8 mm -60.62 -48.78 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 121.877 -0.515 . . . . 0.0 109.996 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 81.4 mt -61.71 -42.24 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.09 -37.74 69.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 685' ' ' PHE . 68.5 t -56.22 -39.87 62.11 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.06 -27.16 68.41 Favored Glycine 0 CA--C 1.543 1.815 0 O-C-N 121.759 -0.588 . . . . 0.0 112.083 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.8 m -64.69 -45.89 84.69 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.621 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.41 -33.08 70.8 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -175.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.683 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -60.06 -41.5 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.23 -0.919 . . . . 0.0 109.278 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.545 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -61.2 -29.7 71.9 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 177.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.576 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.9 OUTLIER -60.35 -37.62 81.24 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.943 0.877 . . . . 0.0 110.056 179.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 23.8 mmt180 -55.35 -27.42 47.18 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.206 1.188 . . . . 0.0 114.206 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.545 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.0 tp -58.0 -36.22 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 120.623 -1.298 . . . . 0.0 109.796 -176.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.576 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.0 p -66.67 -30.98 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.586 -0.696 . . . . 0.0 109.577 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.3 m-85 -56.6 -30.59 63.41 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.309 0.576 . . . . 0.0 109.638 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.52 76.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.402 ' O ' HG23 ' B' ' 705' ' ' VAL . 0.5 OUTLIER -65.85 -40.81 88.63 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.3 tp -57.39 -37.97 73.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.123 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 48.0 m -64.12 -41.44 97.23 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.884 0.849 . . . . 0.0 109.885 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -43.58 98.41 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 122.162 0.982 . . . . 0.0 109.124 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 701' ' ' VAL . 97.9 t -67.51 -40.83 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.165 -0.925 . . . . 0.0 108.878 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -62.69 -36.76 83.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.072 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.562 ' NH2' HD22 ' A' ' 704' ' ' LEU . 63.0 mtt-85 -61.94 -47.21 85.9 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 122.263 1.03 . . . . 0.0 109.931 -179.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.524 HG21 ' HA ' ' C' ' 713' ' ' SER . 3.7 t -76.95 -45.55 30.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.727 -178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -37.96 65.11 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.368 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.629 ' O ' HD12 ' B' ' 715' ' ' LEU . 0.0 OUTLIER -101.95 -22.09 14.38 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.124 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 110.08 146.5 11.16 Favored Glycine 0 CA--C 1.53 1.006 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -89.5 -60.55 1.91 Allowed 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.09 -0.653 . . . . 0.0 112.339 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.71 159.31 85.65 Favored Pre-proline 0 CA--C 1.538 0.513 0 O-C-N 121.516 -0.74 . . . . 0.0 109.33 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.43 ' HB3' HD23 ' A' ' 748' ' ' LEU . 43.3 Cg_exo -27.47 139.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.931 2.421 . . . . 0.0 114.26 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.719 HD13 ' CG ' ' A' ' 758' ' ' ASP . 8.7 tt -106.22 -20.46 13.39 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 122.396 1.093 . . . . 0.0 111.814 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 N--CA 1.466 0.35 0 CA-C-O 122.095 0.95 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -57.99 -26.64 62.61 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.262 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -13.58 1.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.811 -0.556 . . . . 0.0 112.264 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.53 ' HE ' HD12 ' A' ' 774' ' ' LEU . 51.4 mtm-85 -66.01 -46.29 78.47 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.498 -0.751 . . . . 0.0 110.915 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -30.97 67.57 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.728 -0.607 . . . . 0.0 109.588 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -48.87 51.82 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-O 121.416 0.627 . . . . 0.0 109.716 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.3 p -58.35 -44.43 88.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 122.111 -0.368 . . . . 0.0 110.643 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.66 -20.16 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.49 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -59.43 -33.69 71.57 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.6 ' O ' HD23 ' B' ' 748' ' ' LEU . 0.9 OUTLIER -58.67 -16.28 15.57 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 22.3 t -55.96 -53.8 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.414 ' ND2' HD23 ' A' ' 785' ' ' LEU . 4.4 m-80 -72.04 -24.73 61.58 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.067 175.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.2 -20.6 36.32 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.236 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 2.3 m -58.99 -40.6 85.34 Favored 'General case' 0 C--O 1.235 0.33 0 O-C-N 121.99 -0.712 . . . . 0.0 109.238 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 19.9 tp -65.7 -51.15 61.62 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.401 0.62 . . . . 0.0 109.378 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -60.65 -35.17 75.55 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.187 0.518 . . . . 0.0 111.345 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.43 -45.23 92.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.173 0.511 . . . . 0.0 110.891 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.02 -37.64 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -68.82 -30.34 68.87 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.301 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' C' ' 715' ' ' LEU . 68.1 m-20 -55.25 -49.32 72.34 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.346 -0.846 . . . . 0.0 110.27 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -70.42 -41.09 73.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.723 0.773 . . . . 0.0 110.567 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -36.23 83.45 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.198 -178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.1 -50.28 9.24 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.256 0.55 . . . . 0.0 111.775 -178.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 61.6 m -61.81 -46.09 91.02 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.825 0.821 . . . . 0.0 111.116 -178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.502 ' O ' HD13 ' B' ' 774' ' ' LEU . 8.4 tt -69.02 -53.67 19.26 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' B' ' 771' ' ' LEU . 1.2 m -97.73 -39.43 9.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -176.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . 0.544 HD13 HD11 ' B' ' 774' ' ' LEU . 0.5 OUTLIER 81.8 -167.59 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -177.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -38.37 -66.88 0.23 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 9.5 t -114.82 168.96 9.44 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.606 0.717 . . . . 0.0 111.713 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.92 -17.64 62.08 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.114 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -38.94 91.94 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -67.86 -29.91 69.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.744 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' B' ' 764' ' ' SER . 6.6 tt -59.79 -34.62 73.27 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 122.023 -0.423 . . . . 0.0 109.961 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 40.6 mmm-85 -61.19 -37.95 84.81 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -68.94 -43.64 74.66 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.283 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.544 HD11 HD13 ' B' ' 765' ' ' LEU . 9.3 mt -66.99 -38.21 85.61 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.752 0.787 . . . . 0.0 110.584 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.695 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.0 OUTLIER -66.91 -38.62 86.57 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.022 -179.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.42 -41.65 60.53 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 121.554 -0.716 . . . . 0.0 111.567 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . 0.575 HD12 ' N ' ' B' ' 778' ' ' VAL . 2.7 pp -68.19 -37.09 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 120.524 -0.471 . . . . 0.0 110.501 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.575 ' N ' HD12 ' B' ' 777' ' ' ILE . 0.7 OUTLIER -55.56 -45.5 78.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.655 -0.653 . . . . 0.0 109.328 -179.296 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.818 ' O ' HG22 ' B' ' 782' ' ' VAL . 29.7 p -64.46 -42.13 96.11 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 111.395 178.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -31.82 72.37 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.433 ' HB ' HG21 ' C' ' 746' ' ' ILE . 79.3 mt -61.07 -36.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.818 HG22 ' O ' ' B' ' 779' ' ' THR . 11.4 m -54.16 -37.4 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 O-C-N 121.413 -0.805 . . . . 0.0 110.043 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -54.31 -46.32 72.77 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.528 0.68 . . . . 0.0 110.505 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 45.3 tp -66.23 -44.32 84.12 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.051 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' C' ' 747' ' ' ARG . 5.1 tp -71.77 -23.91 61.66 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.183 0.516 . . . . 0.0 111.129 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.86 -41.45 20.58 Favored Glycine 0 CA--C 1.531 1.081 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.49 128.94 33.99 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.603 0.716 . . . . 0.0 110.462 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.071 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.618 HD13 HD12 ' B' ' 663' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 121.592 0.71 . . . . 0.0 109.218 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 49.3 mt 59.96 113.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.46 0.648 . . . . 0.0 110.9 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -172.88 170.44 4.55 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.881 0.848 . . . . 0.0 110.524 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.67 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.4 OUTLIER -55.49 -53.97 49.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.466 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.67 ' N ' HD13 ' C' ' 663' ' ' LEU . 5.4 t70 -72.7 -15.74 61.68 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.775 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.06 -42.57 31.85 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.141 0.496 . . . . 0.0 110.896 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -69.2 -46.14 68.17 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.461 0.648 . . . . 0.0 110.949 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.66 -27.84 66.73 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.652 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 32.8 t -63.23 -26.49 68.82 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.138 0.494 . . . . 0.0 111.694 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -39.75 95.09 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.093 0.473 . . . . 0.0 111.569 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -60.44 -21.17 62.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.017 0.437 . . . . 0.0 111.642 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -79.13 -29.4 43.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.358 0.599 . . . . 0.0 111.093 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -58.45 -52.18 66.71 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.592 0.71 . . . . 0.0 110.51 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.6 t80 58.54 59.9 2.77 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 122.173 0.987 . . . . 0.0 111.068 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -176.0 -76.26 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.138 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.424 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.4 OUTLIER -67.42 -36.76 77.41 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-O 121.593 0.711 . . . . 0.0 111.947 -178.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 8.0 m -51.41 -32.43 26.33 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -55.79 -43.51 76.89 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.708 -0.62 . . . . 0.0 110.986 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.623 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.68 -44.52 96.79 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.512 0.673 . . . . 0.0 109.863 179.246 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -35.86 81.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.015 0.436 . . . . 0.0 111.792 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -88.33 -17.87 29.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -101.45 -20.34 15.17 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.687 -0.633 . . . . 0.0 112.121 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.762 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -60.5 -36.68 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 O-C-N 121.784 -0.573 . . . . 0.0 110.904 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.762 ' N ' HD12 ' C' ' 682' ' ' ILE . 5.6 ttt-85 -58.22 -46.74 85.34 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.717 0.77 . . . . 0.0 109.378 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 59.1 mt -71.15 -35.18 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-O 121.391 0.615 . . . . 0.0 109.673 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.52 -31.11 69.09 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.9 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.412 HD12 ' CG2' ' B' ' 686' ' ' ILE . 14.0 mm -61.05 -44.2 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 75.5 mt -62.25 -37.5 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 177.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.17 -40.95 85.01 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 86.7 t -54.97 -43.83 70.88 Favored 'Isoleucine or valine' 0 C--N 1.347 0.471 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.44 -39.2 43.87 Favored Glycine 0 CA--C 1.534 1.23 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.39 -38.88 85.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.307 1.051 . . . . 0.0 109.519 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -61.01 -46.26 91.47 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.474 HD11 HD23 ' A' ' 692' ' ' LEU . 1.3 pp -65.75 -41.57 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.388 0.613 . . . . 0.0 110.157 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.575 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.8 -35.23 89.65 Favored Glycine 0 CA--C 1.535 1.319 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.585 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.0 tt -56.11 -37.62 69.66 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.086 0.946 . . . . 0.0 110.095 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.683 ' HE ' HD11 ' B' ' 693' ' ' ILE . 31.1 mmt180 -55.83 -28.17 55.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.575 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.5 tt -58.28 -35.59 54.21 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 121.158 -0.964 . . . . 0.0 111.082 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.585 HG12 ' O ' ' C' ' 695' ' ' LEU . 10.8 p -54.28 -29.68 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -56.22 -31.14 63.24 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.728 -0.607 . . . . 0.0 110.735 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.07 -37.66 77.62 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.23 -40.91 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -60.54 -38.34 84.13 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.536 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 43.8 p -64.17 -36.49 84.22 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.286 0.565 . . . . 0.0 110.594 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -43.29 96.8 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 122.174 0.988 . . . . 0.0 108.533 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.94 -45.05 99.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.883 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -62.71 -36.77 84.05 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.407 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.453 ' HG2' ' HB3' ' C' ' 712' ' ' TYR . 0.0 OUTLIER -62.13 -50.22 72.76 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.409 -0.807 . . . . 0.0 110.333 -177.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.418 HG12 ' CD1' ' C' ' 748' ' ' LEU . 0.9 OUTLIER -77.57 -44.19 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -177.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.06 -44.58 65.49 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -104.1 -22.25 13.45 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.34 173.82 16.09 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -178.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . 0.453 ' HB3' ' HG2' ' C' ' 707' ' ' ARG . 14.3 p90 -134.49 -58.37 0.83 Allowed 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.6 -0.941 . . . . 0.0 112.628 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.524 ' HA ' HG21 ' B' ' 708' ' ' VAL . 53.1 p -64.19 154.46 82.64 Favored Pre-proline 0 C--N 1.343 0.307 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.574 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -36.41 96.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.806 0 C-N-CA 121.933 1.755 . . . . 0.0 111.554 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.477 HD23 ' OD2' ' B' ' 758' ' ' ASP . 5.8 tp -82.83 16.85 2.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -175.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.009 0.909 . . . . 0.0 109.728 179.134 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 121.824 0.821 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -40.79 95.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.094 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.72 -38.1 77.62 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.063 0.459 . . . . 0.0 111.821 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.501 ' O ' HD13 ' C' ' 746' ' ' ILE . 11.3 ttm-85 -58.3 -36.51 73.44 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.099 -0.376 . . . . 0.0 111.191 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.52 -42.98 88.95 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -71.28 -44.17 65.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.71 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -27.97 58.98 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.36 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.501 HD13 ' O ' ' C' ' 742' ' ' ARG . 1.3 mp -58.15 -14.64 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . 0.477 ' HA ' HD22 ' B' ' 785' ' ' LEU . 0.1 OUTLIER -59.45 -25.5 64.42 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 121.315 -0.865 . . . . 0.0 108.783 178.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' C' ' 708' ' ' VAL . 0.8 OUTLIER -55.38 -24.71 31.36 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.885 177.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 51.4 t -55.76 -54.03 30.78 Favored 'Isoleucine or valine' 0 C--N 1.349 0.577 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.456 ' ND2' HD23 ' B' ' 785' ' ' LEU . 5.4 m-80 -72.54 -22.81 60.96 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.746 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.1 -20.73 36.05 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.136 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.8 t -58.78 -40.87 85.25 Favored 'General case' 0 C--O 1.234 0.237 0 O-C-N 122.031 -0.688 . . . . 0.0 109.458 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.4 tp -66.63 -48.96 67.81 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.371 0.605 . . . . 0.0 110.254 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . 0.4 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.89 -35.22 79.94 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 111.86 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.459 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.4 tt -59.26 -45.16 91.95 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 110.74 -178.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 51.1 mt -68.55 -36.36 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 121.502 0.668 . . . . 0.0 109.714 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.66 -30.36 69.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.34 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -55.44 -45.37 76.84 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.737 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.49 -45.18 66.16 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 179.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.86 -45.96 69.69 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -67.3 -47.82 69.45 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.3 m -64.07 -45.15 90.02 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.901 0.858 . . . . 0.0 110.58 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.39 -53.31 24.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.416 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.0 OUTLIER -98.23 -36.92 9.88 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.044 -1.035 . . . . 0.0 113.309 -177.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' C' ' 766' ' ' PHE . 60.5 mt 65.0 177.68 0.19 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -177.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . 0.416 ' C ' ' O ' ' C' ' 765' ' ' LEU . 27.6 t80 -7.01 -66.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -178.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 54.7 p -130.38 172.38 11.93 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.171 0.51 . . . . 0.0 110.676 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.82 -15.73 63.77 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.792 0.33 . . . . 0.0 111.32 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -63.76 -42.16 97.86 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -64.07 -30.33 71.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.801 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.416 HD12 ' OG ' ' C' ' 764' ' ' SER . 0.8 OUTLIER -60.16 -32.3 70.92 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.953 -0.467 . . . . 0.0 110.015 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 17.3 ttt-85 -62.6 -38.82 91.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -67.7 -43.95 78.88 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.446 HD22 HD12 ' C' ' 777' ' ' ILE . 3.3 mm? -61.39 -37.47 83.54 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.435 ' O ' HG22 ' C' ' 778' ' ' VAL . 1.0 OUTLIER -57.71 -36.26 71.76 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.243 1.021 . . . . 0.0 108.707 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 776' ' ' LEU . 8.6 tt -74.31 -41.33 61.33 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.704 0.764 . . . . 0.0 109.543 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.728 HG22 HD11 ' C' ' 781' ' ' ILE . 94.3 mt -60.91 -45.63 97.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.87 -179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.493 HG12 HG12 ' A' ' 746' ' ' ILE . 32.7 m -57.74 -39.19 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.57 -0.706 . . . . 0.0 111.102 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.589 ' O ' HG22 ' C' ' 782' ' ' VAL . 7.2 m -63.22 -48.02 80.05 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.629 -0.67 . . . . 0.0 112.065 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -31.81 72.0 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.751 -0.593 . . . . 0.0 111.451 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.728 HD11 HG22 ' C' ' 777' ' ' ILE . 63.4 mt -60.1 -40.22 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.368 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.589 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -53.02 -38.03 28.14 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 CA-C-N 120.185 1.357 . . . . 0.0 109.555 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -42.34 94.16 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 121.786 -0.571 . . . . 0.0 109.588 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.84 -45.01 65.29 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.754 HD13 ' HD3' ' A' ' 744' ' ' ARG . 17.9 tp -78.6 -18.86 53.92 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.985 -1.072 . . . . 0.0 110.441 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.26 -26.09 12.89 Favored Glycine 0 CA--C 1.54 1.643 0 N-CA-C 109.9 -1.28 . . . . 0.0 109.9 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 141.67 47.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 118.167 -0.92 . . . . 0.0 110.301 179.627 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 tp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.514 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.5 mp 61.57 116.34 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.469 0.652 . . . . 0.0 110.279 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -177.33 173.39 1.74 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.491 0.662 . . . . 0.0 110.086 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.4 tt -51.68 -43.25 62.66 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.675 0.75 . . . . 0.0 111.118 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.31 -34.89 71.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.752 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.0 mmtt -72.03 -43.08 65.54 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.178 0.514 . . . . 0.0 111.301 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -67.07 -46.41 74.36 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.133 0.492 . . . . 0.0 110.596 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.44 90.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.376 0.608 . . . . 0.0 111.446 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.26 -33.25 69.18 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.248 0.547 . . . . 0.0 111.085 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.917 HD23 HG23 ' A' ' 676' ' ' THR . 10.9 tp -62.5 -25.57 68.08 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 122.168 -0.332 . . . . 0.0 111.799 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -61.3 -24.68 66.59 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.736 -0.603 . . . . 0.0 111.127 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -74.87 -31.38 61.6 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.334 0.588 . . . . 0.0 110.858 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 17.7 m95 -55.43 -50.46 69.74 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.683 0.754 . . . . 0.0 109.942 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 17.5 t80 58.7 12.34 2.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -124.98 -60.36 1.36 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.595 -0.691 . . . . 0.0 110.55 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.2 tp -68.49 -36.66 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.485 0.66 . . . . 0.0 110.751 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.917 HG23 HD23 ' A' ' 669' ' ' LEU . 0.2 OUTLIER -51.72 -33.87 36.49 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -175.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -63.7 -49.75 71.88 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.2 0.909 . . . . 0.0 110.253 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.749 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.6 t90 -65.59 -43.85 88.43 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.724 0.773 . . . . 0.0 109.525 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -35.71 81.87 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.8 t90 -101.64 -17.84 16.14 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -92.41 -8.21 45.45 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.432 -0.792 . . . . 0.0 112.053 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.749 HG23 ' O ' ' A' ' 678' ' ' TRP . 5.3 pt -61.06 -36.96 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.708 -0.62 . . . . 0.0 111.002 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.88 -47.44 71.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.946 0.403 . . . . 0.0 110.578 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.0 mp -70.71 -33.45 52.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 177.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.503 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.5 OUTLIER -59.81 -32.48 70.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.892 -179.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.968 HD12 HG21 ' C' ' 686' ' ' ILE . 11.0 mm -62.68 -43.25 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-O 121.526 0.679 . . . . 0.0 109.19 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 54.5 mt -66.65 -41.23 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.99 -38.27 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 685' ' ' PHE . 78.7 t -56.99 -41.03 76.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 177.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -58.31 -39.26 92.38 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 109.187 -1.565 . . . . 0.0 109.187 177.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -61.22 -38.9 88.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.318 1.056 . . . . 0.0 109.663 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.56 -46.1 91.46 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.791 -178.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.635 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -58.04 -42.2 82.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.72 -36.54 92.87 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.466 ' O ' HD23 ' A' ' 695' ' ' LEU . 2.8 tt -59.57 -41.88 91.2 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.835 0.826 . . . . 0.0 110.146 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.476 ' HG3' HD13 ' C' ' 693' ' ' ILE . 30.8 mmt180 -56.12 -28.55 58.3 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 49.1 mm -58.96 -35.68 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 O-C-N 121.52 -0.738 . . . . 0.0 110.831 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 4.1 p -53.98 -29.56 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 O-C-N 121.436 -0.79 . . . . 0.0 110.126 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -55.65 -30.85 61.71 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.843 -0.536 . . . . 0.0 110.41 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.72 77.44 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.21 -41.17 86.44 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.25 -36.98 76.45 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.746 178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . 0.429 ' HA ' ' HB2' ' A' ' 706' ' ' ASN . 0.9 OUTLIER -61.98 -41.66 98.28 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.358 0.599 . . . . 0.0 110.507 -178.308 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 704' ' ' LEU . 0.8 OUTLIER -60.94 -40.91 95.07 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 122.026 0.917 . . . . 0.0 108.982 178.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -68.33 -41.82 83.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.914 0.864 . . . . 0.0 108.908 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 703' ' ' SER . 2.3 m120 -62.72 -45.01 94.73 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -61.08 -39.33 89.5 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.815 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -75.9 -44.48 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 122.246 1.022 . . . . 0.0 108.824 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -69.56 -16.81 63.49 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.595 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -93.84 7.75 43.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.494 -0.754 . . . . 0.0 112.644 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 71.83 42.7 52.57 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 110.121 -1.191 . . . . 0.0 110.121 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 65.55 -167.47 0.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.117 0.961 . . . . 0.0 109.935 -178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.548 ' OG ' HG23 ' C' ' 708' ' ' VAL . 16.8 p -62.72 160.35 36.66 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.671 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.416 ' CG ' HD12 ' C' ' 748' ' ' LEU . 10.7 Cg_exo -24.34 100.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 123.86 3.04 . . . . 0.0 115.608 -178.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.667 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.3 pt? -109.55 -20.26 12.93 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.336 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 123.068 1.414 . . . . 0.0 109.863 -178.527 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 124.244 1.973 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.38 -25.24 59.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 113.64 -1.618 . . . . 0.0 112.486 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -54.21 -30.27 49.33 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.567 ' O ' HD12 ' A' ' 746' ' ' ILE . 2.4 ttp180 -61.12 -42.68 98.98 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.406 -0.809 . . . . 0.0 110.775 178.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.93 -44.34 91.33 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.799 0.809 . . . . 0.0 110.02 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -36.89 72.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . 0.449 ' HA ' HD23 ' A' ' 748' ' ' LEU . 42.9 p -64.58 -28.17 69.45 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.786 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.567 HD12 ' O ' ' A' ' 742' ' ' ARG . 0.9 OUTLIER -74.0 -47.1 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.695 178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.591 ' HB3' HD23 ' C' ' 785' ' ' LEU 0.28 9.4 ttt180 -71.9 0.73 8.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.763 -178.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.538 HD21 ' CG ' ' B' ' 714' ' ' PRO . 1.1 mm? -55.71 -16.61 4.48 Favored 'General case' 0 C--N 1.375 1.691 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 168.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' A' ' 747' ' ' ARG 0.313 1.4 t -53.52 -54.77 16.64 Favored 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.504 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.4 m-80 -73.52 -28.38 61.86 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.261 174.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.15 -20.49 35.57 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.528 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 81.2 p -58.23 -37.58 75.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 117.741 0.77 . . . . 0.0 109.187 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 38.1 tp -66.75 -51.14 59.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.185 0.517 . . . . 0.0 109.748 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.62 -35.07 79.3 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.226 0.536 . . . . 0.0 112.106 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.492 HD21 ' NE2' ' B' ' 710' ' ' GLN . 4.7 tt -59.18 -45.36 91.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.977 0.417 . . . . 0.0 111.411 -177.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 51.4 mt -65.41 -31.88 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 121.335 0.588 . . . . 0.0 109.862 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.54 -30.74 68.63 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 122.049 -0.407 . . . . 0.0 111.799 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -55.67 -46.59 77.53 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.586 -0.696 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -43.32 70.09 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.461 0.648 . . . . 0.0 110.899 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 763' ' ' LEU . 7.2 mt -60.99 -33.36 73.11 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.253 0.549 . . . . 0.0 111.463 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 765' ' ' LEU . 71.6 mtt180 -82.33 -22.15 35.72 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.4 m -75.3 -46.68 31.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 120.959 -1.088 . . . . 0.0 112.299 -177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.452 HD11 ' HA ' ' A' ' 760' ' ' LEU . 0.1 OUTLIER -69.65 -53.72 17.34 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -41.49 8.2 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.411 ' HA ' ' O ' ' A' ' 761' ' ' ARG . 1.2 tt 92.1 -64.58 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.212 1.005 . . . . 0.0 111.787 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -151.2 25.08 0.72 Allowed 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.616 -0.677 . . . . 0.0 112.732 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 18.9 p -176.34 138.33 0.31 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.596 -0.69 . . . . 0.0 110.818 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.86 -5.34 25.12 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.861 0.362 . . . . 0.0 111.46 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -82.83 -38.6 22.82 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -61.31 -30.28 70.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.258 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -59.98 -33.42 71.92 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.043 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -57.03 -38.06 72.62 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.28 -38.13 78.2 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.639 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.538 ' C ' HD13 ' A' ' 774' ' ' LEU . 2.8 tm? -58.19 -39.57 79.28 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 121.302 0.572 . . . . 0.0 109.805 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 2.2 tp -61.65 -36.2 80.12 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.547 0.689 . . . . 0.0 110.783 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -45.36 52.5 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.962 0.41 . . . . 0.0 111.161 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.796 HD13 ' N ' ' A' ' 778' ' ' VAL . 0.0 OUTLIER -69.94 -37.59 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 122.046 -0.409 . . . . 0.0 110.076 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.796 ' N ' HD13 ' A' ' 777' ' ' ILE . 13.4 p -61.64 -42.87 95.87 Favored 'Isoleucine or valine' 0 C--N 1.348 0.54 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.848 ' O ' HG22 ' A' ' 782' ' ' VAL . 9.1 m -64.21 -35.84 82.13 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 121.306 0.574 . . . . 0.0 110.33 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . 0.692 ' NH2' HD21 ' A' ' 784' ' ' LEU . 0.7 OUTLIER -63.67 -37.65 88.14 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.611 HG21 HG23 ' B' ' 746' ' ' ILE . 72.8 mt -54.01 -39.71 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 121.796 -0.565 . . . . 0.0 111.342 -178.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.848 HG22 ' O ' ' A' ' 779' ' ' THR . 6.8 m -54.76 -35.75 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 120.933 0.397 . . . . 0.0 111.041 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -53.81 -51.12 64.51 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -176.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.692 HD21 ' NH2' ' A' ' 780' ' ' ARG . 0.0 OUTLIER -70.59 -32.98 70.55 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 mp -84.59 -25.46 28.62 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.751 -0.593 . . . . 0.0 111.94 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.62 -45.91 89.59 Favored Glycine 0 CA--C 1.529 0.96 0 N-CA-C 109.989 -1.244 . . . . 0.0 109.989 178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -88.28 145.29 25.94 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.539 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.146 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.51 HD12 ' N ' ' B' ' 660' ' ' LEU . 6.5 mp . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.707 0.765 . . . . 0.0 109.115 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.468 HD12 ' N ' ' B' ' 661' ' ' LEU . 7.9 mp 45.5 90.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.556 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.76 52.42 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 122.112 0.958 . . . . 0.0 111.409 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.623 ' CD1' HD22 ' C' ' 660' ' ' LEU . 13.6 tp 77.77 -46.45 0.46 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.275 1.03 . . . . 0.0 110.151 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -34.29 72.12 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.438 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.64 -41.38 27.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.825 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -75.19 -42.4 55.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.04 0.448 . . . . 0.0 111.742 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.96 -29.69 64.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.393 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.5 m -62.43 -33.79 75.49 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.084 0.468 . . . . 0.0 111.195 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -27.19 68.93 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.027 0.441 . . . . 0.0 111.588 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 35.0 m95 -59.79 -32.62 70.79 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.156 0.503 . . . . 0.0 111.002 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -69.6 -27.86 65.46 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.105 0.479 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -67.86 -61.5 1.84 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.513 0.673 . . . . 0.0 110.336 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 11.9 t80 63.53 24.49 14.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -132.64 -82.15 0.49 Allowed 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.446 -0.784 . . . . 0.0 111.23 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.711 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.2 OUTLIER -62.42 -36.04 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.417 0.627 . . . . 0.0 110.611 179.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.0 m -50.73 -33.13 21.75 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.02 -0.425 . . . . 0.0 110.749 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 19.7 m-20 -56.48 -49.71 73.86 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' B' ' 682' ' ' ILE . 4.1 t90 -66.06 -43.57 87.04 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.81 0.814 . . . . 0.0 109.357 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 675' ' ' ILE . 0.1 OUTLIER -58.15 -35.15 71.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.064 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -105.55 -33.74 8.0 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -176.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -70.09 -8.71 51.66 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.33 -35.8 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.506 -0.746 . . . . 0.0 111.456 179.542 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -47.3 68.74 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 122.118 -0.364 . . . . 0.0 110.907 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.463 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -68.31 -36.21 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.493 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.6 OUTLIER -59.82 -30.8 69.18 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.246 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.896 HD12 HG21 ' A' ' 686' ' ' ILE . 13.0 mm -60.91 -47.11 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.142 0.496 . . . . 0.0 109.762 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 70.3 mt -61.21 -39.44 82.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' B' ' 685' ' ' PHE . 96.6 mt -58.72 -37.57 66.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 685' ' ' PHE . 96.9 t -56.17 -41.93 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.52 -28.21 59.35 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.2 -37.44 87.49 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 122.996 0.518 . . . . 0.0 110.975 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.26 -45.83 87.12 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.224 0.535 . . . . 0.0 109.997 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.74 HD11 ' NE ' ' C' ' 696' ' ' ARG . 0.0 OUTLIER -68.34 -40.25 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 O-C-N 122.174 -0.329 . . . . 0.0 110.945 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.694 ' O ' HD12 ' B' ' 697' ' ' ILE . . . -61.89 -38.44 96.0 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 109.906 -1.278 . . . . 0.0 109.906 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.595 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -64.62 -36.49 84.41 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.411 1.1 . . . . 0.0 110.705 178.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.628 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -54.78 -28.57 49.85 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -176.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.729 HD13 ' H ' ' B' ' 698' ' ' VAL . 0.1 OUTLIER -58.55 -35.57 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 120.839 -1.163 . . . . 0.0 110.092 -177.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.729 ' H ' HD13 ' B' ' 697' ' ' ILE . 9.9 p -54.34 -30.3 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.263 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -56.7 -31.47 64.51 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 121.96 -0.462 . . . . 0.0 109.859 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.33 -38.38 80.19 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.02 -39.2 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tp -62.0 -36.38 81.34 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.326 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -62.1 -37.18 84.1 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 122.04 -0.413 . . . . 0.0 110.563 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.46 HD22 ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -63.6 -42.59 98.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 122.215 1.007 . . . . 0.0 108.349 177.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.581 HG13 HD13 ' B' ' 748' ' ' LEU . 90.4 t -64.04 -45.39 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.981 0.896 . . . . 0.0 109.05 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.81 -35.84 81.21 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.247 178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.46 ' NH2' HD22 ' B' ' 704' ' ' LEU . 1.7 ttm105 -59.2 -50.47 73.89 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.822 -1.174 . . . . 0.0 110.393 -178.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.549 HG21 ' HD2' ' C' ' 714' ' ' PRO . 0.6 OUTLIER -78.59 -45.8 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.87 0.843 . . . . 0.0 112.66 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -74.1 -37.55 64.12 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.047 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.492 ' NE2' HD21 ' A' ' 755' ' ' LEU . 7.5 tt0 -102.07 7.37 41.16 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . 0.422 ' HA3' HD13 ' B' ' 715' ' ' LEU . . . 76.65 136.01 0.68 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -77.01 -49.63 14.96 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 122.233 -0.569 . . . . 0.0 110.005 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.02 157.43 33.72 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.538 ' CG ' HD21 ' A' ' 748' ' ' LEU . 31.2 Cg_exo -36.31 108.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.102 1.868 . . . . 0.0 114.039 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.422 HD13 ' HA3' ' B' ' 711' ' ' GLY . 3.1 tp -80.11 13.93 2.09 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 27.8 p . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.593 0.711 . . . . 0.0 110.433 -179.503 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 121.366 0.603 . . . . 0.0 111.514 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 -71.21 -26.84 63.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.897 -0.502 . . . . 0.0 111.05 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.46 -18.72 7.61 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.89 -0.506 . . . . 0.0 112.038 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -60.52 -39.68 88.66 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.917 -0.489 . . . . 0.0 111.094 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . 0.436 ' O ' ' HB ' ' B' ' 746' ' ' ILE . 1.0 OUTLIER -59.48 -34.75 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . 0.4 ' C ' ' HD2' ' B' ' 744' ' ' ARG . 0.7 OUTLIER -71.88 -39.4 69.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.191 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.6 m -56.23 -22.79 31.72 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.577 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.611 HG23 HG21 ' A' ' 781' ' ' ILE . 0.6 OUTLIER -52.75 -30.53 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.163 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.519 ' HA ' HD21 ' B' ' 750' ' ' ASN . 7.5 mtt180 -63.46 -14.13 47.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.418 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.581 HD13 HG13 ' B' ' 705' ' ' VAL . 55.2 mt -56.13 -40.44 73.78 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 178.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . 0.446 HG23 ' O ' ' B' ' 746' ' ' ILE . 0.1 OUTLIER -55.13 -54.12 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -176.549 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.519 HD21 ' HA ' ' B' ' 747' ' ' ARG . 3.6 p30 -72.53 -16.11 61.77 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.439 0.638 . . . . 0.0 110.582 175.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -58.13 -21.41 46.34 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 4.4 m -64.48 -44.29 91.49 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.958 -0.731 . . . . 0.0 110.341 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' B' ' 757' ' ' TRP . 17.2 tp -68.23 -45.98 71.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.056 0.932 . . . . 0.0 109.436 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.75 76.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.5 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.482 ' C ' HD23 ' B' ' 755' ' ' LEU . 6.8 tt -58.83 -46.3 88.0 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 121.839 -0.538 . . . . 0.0 110.956 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 44.9 pt -76.2 -30.19 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 121.789 0.804 . . . . 0.0 110.575 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . 0.447 ' CZ3' HD11 ' B' ' 753' ' ' LEU . 0.2 OUTLIER -69.25 -30.14 68.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.607 -179.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.15 -49.46 77.16 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.593 -0.692 . . . . 0.0 109.148 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -71.37 -45.33 63.11 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.687 0.756 . . . . 0.0 111.205 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . 0.492 ' C ' HD13 ' B' ' 760' ' ' LEU . 3.1 tm? -64.25 -41.67 96.85 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.345 0.593 . . . . 0.0 112.279 -177.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 35.8 ttp180 -82.1 -21.26 36.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 48.2 t -74.0 -45.65 48.59 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.448 -0.782 . . . . 0.0 112.151 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.663 ' HA ' HD13 ' B' ' 774' ' ' LEU . 5.9 mp -59.88 -54.94 40.32 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.09 -49.62 4.44 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.722 0.773 . . . . 0.0 112.53 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 72.15 120.85 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.656 0.741 . . . . 0.0 109.986 -178.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 15.1 t80 75.21 -69.19 0.18 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.322 0.649 . . . . 0.0 110.809 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 4.8 m -150.93 176.32 11.21 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.858 -0.526 . . . . 0.0 110.796 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -66.59 -172.31 0.16 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 78.35 -51.97 0.49 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.683 0.754 . . . . 0.0 108.985 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 15.1 tpt85 -56.62 -29.57 62.33 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.187 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -59.59 -31.99 69.97 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.937 -0.477 . . . . 0.0 109.874 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -57.18 -34.97 69.03 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.54 0.686 . . . . 0.0 109.181 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.01 -46.05 79.34 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.663 HD13 ' HA ' ' B' ' 763' ' ' LEU . 0.3 OUTLIER -58.65 -42.69 88.96 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.524 0.678 . . . . 0.0 109.325 179.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.656 HD13 ' O ' ' B' ' 775' ' ' LEU . 1.8 tm? -59.03 -39.0 80.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.317 0.58 . . . . 0.0 110.15 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.63 -42.6 77.82 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 122.129 -0.357 . . . . 0.0 111.276 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 52.2 mt -62.89 -41.48 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.584 HG23 ' O ' ' B' ' 774' ' ' LEU . 64.8 t -61.93 -40.36 86.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.152 0.501 . . . . 0.0 110.097 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.544 ' O ' HG22 ' B' ' 782' ' ' VAL . 9.8 m -62.93 -45.84 90.6 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.013 -0.429 . . . . 0.0 112.02 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.96 72.44 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.542 -0.724 . . . . 0.0 111.846 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.492 HD12 HD13 ' C' ' 746' ' ' ILE . 83.5 mt -68.54 -40.18 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.754 -0.591 . . . . 0.0 111.891 -178.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 779' ' ' THR . 19.5 m -56.39 -38.11 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.362 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -63.25 -42.35 99.18 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.745 0.783 . . . . 0.0 109.742 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 22.8 tp -66.91 -41.57 86.9 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.8 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.409 ' HG ' ' CG ' ' C' ' 750' ' ' ASN . 0.0 OUTLIER -65.29 -35.19 80.25 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.102 0.477 . . . . 0.0 110.631 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -30.49 -51.93 0.21 Allowed Glycine 0 CA--C 1.539 1.535 0 C-N-CA 123.366 0.508 . . . . 0.0 113.04 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.59 85.87 2.44 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 122.214 1.007 . . . . 0.0 109.95 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.901 -1.047 . . . . 0.0 111.004 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.623 HD22 ' CD1' ' B' ' 663' ' ' LEU . 3.9 pp . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 121.902 0.858 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.436 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.9 mp -114.59 151.53 33.29 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.322 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -175.46 174.8 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.278 0.561 . . . . 0.0 110.29 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.455 HD23 ' C ' ' C' ' 663' ' ' LEU . 4.5 tt -49.12 -57.1 7.21 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.681 0.753 . . . . 0.0 111.942 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.81 -20.7 66.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.265 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -79.18 -46.11 18.57 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.068 0.461 . . . . 0.0 110.962 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -58.5 -45.91 87.77 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.665 0.745 . . . . 0.0 110.288 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.83 -25.61 64.75 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.298 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 p -64.73 -35.64 81.71 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.276 0.56 . . . . 0.0 110.711 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 29.9 mt -59.91 -30.75 69.25 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.184 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.6 -25.5 64.67 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.963 -0.46 . . . . 0.0 110.857 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -77.79 -27.5 50.21 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.116 0.484 . . . . 0.0 111.277 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -59.34 -40.63 86.96 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.358 0.599 . . . . 0.0 110.515 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER 55.63 32.43 19.23 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.299 0.571 . . . . 0.0 110.985 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -151.53 -69.12 0.17 Allowed 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.646 -0.659 . . . . 0.0 111.953 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.647 HD12 ' CE3' ' C' ' 678' ' ' TRP . 1.6 tp -64.91 -37.6 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 121.83 -0.544 . . . . 0.0 112.053 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 7.4 m -52.51 -43.12 64.89 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.864 -0.523 . . . . 0.0 111.6 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -57.66 -46.45 84.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.659 0.742 . . . . 0.0 110.13 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.647 ' CE3' HD12 ' C' ' 675' ' ' ILE . 4.3 t90 -65.17 -45.1 86.29 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.167 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 47.4 mt -65.75 -38.96 90.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.388 -0.82 . . . . 0.0 112.698 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -84.3 -42.04 16.22 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.891 -0.505 . . . . 0.0 112.171 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -65.81 -30.02 70.59 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.981 -0.449 . . . . 0.0 112.053 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.725 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.6 pp -62.26 -36.86 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 119.89 -0.724 . . . . 0.0 109.304 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.725 ' N ' HD12 ' C' ' 682' ' ' ILE . 17.6 ttt-85 -59.67 -45.2 92.79 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.1 mm -61.35 -42.81 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 122.339 1.066 . . . . 0.0 108.65 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.494 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.71 -27.4 66.41 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.031 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.968 HG21 HD12 ' A' ' 686' ' ' ILE . 18.6 mm -60.27 -44.27 95.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.4 -37.74 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 38.4 mm -60.24 -39.29 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.494 HG23 ' O ' ' C' ' 685' ' ' PHE . 84.5 t -55.69 -41.26 64.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . 0.401 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.08 -40.48 74.23 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.73 -38.23 83.25 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.824 0.821 . . . . 0.0 110.36 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.482 HD23 HD12 ' B' ' 693' ' ' ILE . 3.1 tp -59.42 -46.56 88.36 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' A' ' 696' ' ' ARG . 2.5 pp -61.3 -41.55 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 121.747 -0.596 . . . . 0.0 109.913 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.713 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -61.02 -34.58 88.46 Favored Glycine 0 CA--C 1.533 1.207 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 4.8 tt -60.75 -38.05 83.86 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.267 1.032 . . . . 0.0 110.214 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.74 ' NE ' HD11 ' B' ' 693' ' ' ILE . 22.6 mmt180 -56.37 -28.33 58.85 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.713 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -58.79 -35.34 55.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 O-C-N 121.329 -0.857 . . . . 0.0 111.248 -176.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.9 p -53.72 -30.82 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.259 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -56.73 -31.58 64.68 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.832 -0.542 . . . . 0.0 110.27 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.94 88.63 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -68.92 -40.42 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.99 -37.56 71.82 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 40.0 m -62.39 -35.61 79.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.532 0.682 . . . . 0.0 109.436 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -41.85 99.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 122.343 1.068 . . . . 0.0 108.19 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.55 -45.36 97.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.458 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -62.79 -36.77 84.21 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.114 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.404 ' HA ' ' O ' ' C' ' 711' ' ' GLY . 3.0 ttm-85 -62.41 -50.45 71.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.507 -0.746 . . . . 0.0 111.645 -176.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.548 HG23 ' OG ' ' A' ' 713' ' ' SER . 0.4 OUTLIER -77.65 -44.34 29.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.497 0.665 . . . . 0.0 111.714 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -74.31 -43.22 57.65 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.46 -22.06 14.13 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -174.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . 0.404 ' O ' ' HA ' ' C' ' 707' ' ' ARG . . . 135.68 -157.92 23.52 Favored Glycine 0 N--CA 1.478 1.441 0 O-C-N 121.317 -0.864 . . . . 0.0 111.675 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 18.8 p90 -147.47 -50.84 0.19 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.382 -1.069 . . . . 0.0 112.556 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 73.5 m -107.75 159.68 29.49 Favored Pre-proline 0 N--CA 1.463 0.183 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.33 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . 0.549 ' HD2' HG21 ' B' ' 708' ' ' VAL . 24.7 Cg_exo -32.97 97.26 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.226 1.951 . . . . 0.0 112.636 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' C' ' 716' ' ' SER . 6.1 tp -70.71 -20.0 62.7 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . 0.496 ' C ' ' O ' ' C' ' 715' ' ' LEU . 2.3 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 122.09 0.947 . . . . 0.0 112.52 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 122.337 1.065 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -61.43 -26.4 67.84 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.934 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -21.3 13.6 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.89 -0.506 . . . . 0.0 111.808 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.414 ' HD2' HD12 ' B' ' 774' ' ' LEU . 31.3 mtm180 -74.28 -30.15 61.98 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.948 -0.47 . . . . 0.0 110.952 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -58.93 -44.27 91.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.564 0.697 . . . . 0.0 109.532 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -71.27 -40.37 70.99 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.213 0.53 . . . . 0.0 110.268 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 2.0 m -58.57 -41.97 86.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.843 0.354 . . . . 0.0 110.364 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.492 HD13 HD12 ' B' ' 781' ' ' ILE . 82.9 mt -58.66 -18.6 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 O-C-N 122.073 -0.392 . . . . 0.0 110.031 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -59.61 -33.3 71.3 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.416 HD12 ' CG ' ' A' ' 714' ' ' PRO . 5.2 tt -58.95 -18.78 36.86 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.579 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . 0.449 HG23 ' O ' ' C' ' 746' ' ' ILE . 93.9 t -55.69 -55.0 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.409 ' CG ' ' HG ' ' B' ' 785' ' ' LEU . 5.4 m-80 -73.58 -20.19 60.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.017 174.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.66 -20.0 30.02 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.193 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 12.6 t -58.21 -37.85 75.62 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.69 -48.78 58.45 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.28 -35.66 74.16 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.493 ' C ' HD23 ' C' ' 755' ' ' LEU . 6.9 tt -59.75 -45.55 91.88 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.346 0.593 . . . . 0.0 110.176 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 42.5 mm -66.31 -36.37 77.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.44 0.638 . . . . 0.0 109.632 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.02 -34.12 74.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.03 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . 0.441 ' OD1' HD21 ' A' ' 715' ' ' LEU . 54.6 m-20 -56.49 -46.37 80.5 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.979 0.895 . . . . 0.0 109.16 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . 0.823 ' O ' HD22 ' C' ' 763' ' ' LEU . 2.9 m-20 -70.4 -45.27 66.29 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.698 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -31.09 69.81 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -80.21 -49.8 11.14 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 11.6 t -65.82 -45.72 81.27 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.823 HD22 ' O ' ' C' ' 759' ' ' ASP . 0.6 OUTLIER -68.31 -37.5 80.66 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -178.142 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.731 ' H ' HD23 ' C' ' 763' ' ' LEU . 83.5 p -98.36 -49.03 4.83 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.621 0.724 . . . . 0.0 111.663 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 2.4 tt 68.4 55.85 0.5 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.454 1.121 . . . . 0.0 109.273 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . 0.415 ' C ' ' HG ' ' C' ' 767' ' ' SER . 0.1 OUTLIER 61.11 152.56 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.451 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . 0.415 ' HG ' ' C ' ' C' ' 766' ' ' PHE . 0.1 OUTLIER 55.14 116.32 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.548 0.69 . . . . 0.0 111.709 179.899 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -26.63 68.84 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.734 -0.604 . . . . 0.0 110.82 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -65.52 -43.21 90.76 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 122.265 1.031 . . . . 0.0 108.293 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -64.72 -29.9 70.9 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.011 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.719 HD12 ' HB3' ' C' ' 764' ' ' SER . 5.0 tt -59.75 -32.21 70.35 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.475 -0.766 . . . . 0.0 110.395 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -38.22 72.78 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.038 -0.414 . . . . 0.0 110.974 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . 0.602 ' OD2' HD22 ' C' ' 774' ' ' LEU . 4.9 p30 -68.29 -33.9 75.18 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.286 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.602 HD22 ' OD2' ' C' ' 773' ' ' ASP . 4.0 mm? -60.25 -38.2 82.76 Favored 'General case' 0 C--N 1.353 0.746 0 CA-C-O 121.838 0.827 . . . . 0.0 110.113 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.792 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.2 mm? -58.17 -36.28 72.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.028 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -32.85 64.49 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.689 -0.632 . . . . 0.0 111.579 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.581 HD12 HD13 ' C' ' 774' ' ' LEU . 8.3 mt -64.87 -37.45 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.356 -179.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.792 HG22 ' O ' ' C' ' 775' ' ' LEU . 4.4 m -55.5 -39.72 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 122.075 -0.391 . . . . 0.0 111.751 -177.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 22.5 m -63.3 -48.21 79.04 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.774 -0.579 . . . . 0.0 110.679 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -31.56 71.98 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.486 0.66 . . . . 0.0 110.486 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.499 HG21 ' HB ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -58.2 -36.62 58.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.579 -179.268 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 747' ' ' ARG . 39.9 t -52.74 -38.82 28.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.579 -0.701 . . . . 0.0 109.148 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -58.6 -41.65 86.3 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.463 -0.773 . . . . 0.0 111.197 177.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 32.8 tp -65.03 -44.58 88.67 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.591 HD23 ' HB3' ' A' ' 747' ' ' ARG . 47.2 tp -83.38 -21.8 32.95 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.432 -0.793 . . . . 0.0 110.715 -178.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -61.69 -36.89 93.36 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -104.99 136.11 45.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.621 0.725 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.533 -179.647 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.0 tp . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.424 0.63 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.42 HD22 ' CZ2' ' A' ' 666' ' ' TRP . 23.5 mt 54.37 64.02 1.96 Allowed 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.643 0.735 . . . . 0.0 109.49 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . 0.404 ' C ' ' H ' ' A' ' 664' ' ' ASP . 1.5 mm-40 -157.61 73.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.785 HD23 ' N ' ' B' ' 660' ' ' LEU . 2.3 tm? 70.79 -35.4 0.33 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.981 0.912 . . . . 0.0 112.742 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 662' ' ' GLU . 11.7 t0 -91.56 -37.16 13.28 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.006 0.431 . . . . 0.0 111.758 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -81.38 -31.44 33.3 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.149 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . 0.42 ' CZ2' HD22 ' A' ' 661' ' ' LEU . 97.1 m95 -74.46 -39.9 62.23 Favored 'General case' 0 C--N 1.34 0.193 0 O-C-N 121.955 -0.466 . . . . 0.0 111.167 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -76.91 -36.27 56.76 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 57.4 p -58.13 -30.84 66.64 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.165 0.507 . . . . 0.0 110.844 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.514 HD22 ' OG1' ' A' ' 676' ' ' THR . 2.4 mt -63.93 -24.1 67.6 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -64.43 -31.13 72.21 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.83 -0.544 . . . . 0.0 111.107 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -69.45 -30.1 67.94 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.309 0.576 . . . . 0.0 111.032 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -57.48 -48.98 77.77 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.503 0.668 . . . . 0.0 110.374 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 t80 53.96 32.12 14.76 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.72 0.771 . . . . 0.0 110.829 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -146.79 -68.59 0.26 Allowed 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.702 -0.624 . . . . 0.0 111.715 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.665 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.2 OUTLIER -68.16 -39.83 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 CA-C-O 121.418 0.628 . . . . 0.0 111.953 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.514 ' OG1' HD22 ' A' ' 669' ' ' LEU . 17.4 m -52.81 -33.8 50.79 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -62.55 -50.15 72.48 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.874 -0.516 . . . . 0.0 111.783 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.708 ' O ' HG23 ' A' ' 682' ' ' ILE . 2.9 t-105 -65.53 -45.58 82.89 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.649 -0.657 . . . . 0.0 110.379 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.416 HD21 HH11 ' C' ' 683' ' ' ARG . 0.1 OUTLIER -67.22 -35.1 78.87 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -86.29 -11.16 53.0 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.784 -0.573 . . . . 0.0 111.933 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -103.81 -21.87 13.61 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.708 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -61.17 -35.46 65.92 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 CA-C-N 120.729 1.604 . . . . 0.0 111.216 179.058 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 16.0 mmm-85 -52.95 -41.52 64.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.799 0.809 . . . . 0.0 109.618 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 88.4 mt -78.52 -40.91 24.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 CA-C-O 122.078 0.942 . . . . 0.0 109.305 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -27.61 68.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.442 -179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.75 -45.37 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.85 -37.31 71.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.0 mt -64.99 -37.55 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.65 -42.7 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . 0.458 ' O ' HG23 ' A' ' 693' ' ' ILE . . . -54.74 -38.9 65.41 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.7 m -67.01 -38.85 86.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.697 0.76 . . . . 0.0 109.48 178.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -46.24 89.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.919 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.687 ' O ' HD12 ' A' ' 693' ' ' ILE . 0.3 OUTLIER -57.9 -41.7 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.837 -179.173 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.93 -31.25 80.18 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.452 ' O ' HG12 ' A' ' 698' ' ' VAL . 2.4 tt -60.03 -40.54 89.69 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.92 0.866 . . . . 0.0 110.031 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.2 mmm180 -55.53 -28.19 53.32 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.88 0.872 . . . . 0.0 112.112 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 45.3 mm -58.05 -35.33 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.52 -0.738 . . . . 0.0 109.624 -177.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.694 ' O ' HG22 ' A' ' 701' ' ' VAL . 3.3 p -54.02 -28.65 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 O-C-N 121.784 -0.572 . . . . 0.0 110.221 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 19.4 m-85 -54.55 -28.48 46.06 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.83 -0.544 . . . . 0.0 110.651 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.94 -37.42 71.49 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 698' ' ' VAL . 5.4 m -67.29 -35.95 75.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.23 -38.2 87.35 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.032 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 69.9 m -67.26 -40.92 86.27 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.248 0.546 . . . . 0.0 109.851 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.776 HD23 ' HD2' ' A' ' 707' ' ' ARG . 13.1 mt -64.91 -42.68 94.53 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-O 121.784 0.802 . . . . 0.0 109.331 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.581 HG23 ' CB ' ' A' ' 748' ' ' LEU . 0.5 OUTLIER -63.56 -41.49 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.948 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 2.2 m120 -60.93 -44.57 97.04 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.776 ' HD2' HD23 ' A' ' 704' ' ' LEU . 0.0 OUTLIER -64.94 -35.76 82.22 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.853 0.835 . . . . 0.0 110.575 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.0 t -75.59 -45.44 39.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.451 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -74.89 -14.58 60.67 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.8 OUTLIER -83.09 6.97 17.25 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.035 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.63 27.8 Favored Glycine 0 CA--C 1.539 1.57 0 O-C-N 122.024 -0.422 . . . . 0.0 113.17 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 61.6 -143.41 0.45 Allowed 'General case' 0 CA--C 1.56 1.351 0 O-C-N 121.738 -0.86 . . . . 0.0 110.435 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.468 ' HB2' HG21 ' C' ' 708' ' ' VAL . 81.7 p -62.12 159.7 36.32 Favored Pre-proline 0 C--N 1.351 0.667 0 O-C-N 121.293 -0.88 . . . . 0.0 110.682 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -41.57 104.56 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.585 1.523 . . . . 0.0 112.576 -178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.611 ' H ' HD23 ' A' ' 715' ' ' LEU . 2.1 pt? -108.82 -20.57 13.02 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -177.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 121.536 0.684 . . . . 0.0 110.682 -179.442 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.311 1.053 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -57.93 -25.09 60.44 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.873 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.34 -9.86 0.33 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -175.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 37.8 ttp-105 -69.65 -31.86 70.19 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.366 -0.834 . . . . 0.0 109.151 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -69.59 -45.06 69.5 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -71.11 -31.8 68.22 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.839 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 84.2 p -61.31 -42.57 98.89 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.718 HG22 HD13 ' C' ' 781' ' ' ILE . 48.3 mt -57.65 -16.49 5.81 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -58.46 -25.28 62.09 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.96 -1.088 . . . . 0.0 108.87 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 748' ' ' LEU . 0.5 OUTLIER -60.49 -14.76 21.32 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 746' ' ' ILE . 0.0 OUTLIER -54.33 -54.18 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.725 0 CA-C-N 121.4 1.909 . . . . 0.0 105.882 178.784 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -72.81 -20.43 61.14 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.074 -1.875 . . . . 0.0 110.993 177.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 748' ' ' LEU . . . -57.31 -20.96 38.5 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.04 -178.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 7.2 m -61.46 -40.56 94.95 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.887 -0.772 . . . . 0.0 110.084 179.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 21.0 tp -69.6 -50.87 40.4 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.56 0.695 . . . . 0.0 109.802 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.18 -34.83 78.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.176 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.501 ' C ' HD23 ' A' ' 755' ' ' LEU . 10.4 tt -59.5 -45.44 91.69 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.904 -0.497 . . . . 0.0 110.619 -177.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 43.0 mm -64.93 -34.8 72.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 121.725 0.774 . . . . 0.0 109.326 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -33.93 75.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.627 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.444 ' OD1' HD23 ' B' ' 715' ' ' LEU . 3.7 m-20 -57.26 -43.05 82.67 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.353 -0.842 . . . . 0.0 109.343 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -70.35 -44.33 68.38 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.664 0.745 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.522 ' HA ' HD11 ' A' ' 763' ' ' LEU . 12.9 mt -65.08 -32.55 74.31 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.651 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -82.39 -22.55 35.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -46.94 24.44 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.321 -0.862 . . . . 0.0 111.675 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 771' ' ' LEU . 0.1 OUTLIER -69.13 -53.4 20.38 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.514 -0.741 . . . . 0.0 111.899 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . 0.471 ' H ' HD12 ' A' ' 763' ' ' LEU . 10.0 p -97.79 -49.16 4.92 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.482 -0.761 . . . . 0.0 112.454 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.449 ' O ' HD23 ' A' ' 765' ' ' LEU . 0.6 OUTLIER 75.94 -7.64 1.77 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.984 0.514 . . . . 0.0 111.036 -178.001 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -174.95 121.42 0.22 Allowed 'General case' 0 C--N 1.347 0.493 0 O-C-N 121.346 -0.846 . . . . 0.0 110.985 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 67.1 m 48.96 -96.71 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.402 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.781 ' CE1' HD23 ' A' ' 771' ' ' LEU . 21.7 t80 -166.68 -21.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.243 -0.911 . . . . 0.0 112.252 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -52.43 -37.44 56.8 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.406 0.622 . . . . 0.0 110.385 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -70.31 -30.59 67.62 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.372 0.606 . . . . 0.0 111.029 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.781 HD23 ' CE1' ' A' ' 768' ' ' TYR . 0.2 OUTLIER -60.61 -34.2 73.88 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.234 0.54 . . . . 0.0 109.926 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 -41.78 77.87 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -65.76 -34.48 78.27 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.976 HD22 HD11 ' A' ' 777' ' ' ILE . 0.4 OUTLIER -58.24 -38.81 77.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.337 0.589 . . . . 0.0 110.489 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 778' ' ' VAL . 6.6 tp -59.52 -36.96 77.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.235 0.54 . . . . 0.0 112.239 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . 0.519 ' C ' HD13 ' A' ' 776' ' ' LEU . 2.4 tm? -74.69 -42.45 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.631 -0.668 . . . . 0.0 111.634 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.976 HD11 HD22 ' A' ' 774' ' ' LEU . 29.2 pt -65.21 -35.93 76.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.502 ' O ' ' HB ' ' A' ' 781' ' ' ILE . 17.5 m -54.55 -38.95 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.954 0.797 . . . . 0.0 110.171 -178.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 17.8 p -63.07 -35.91 81.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 118.447 -1.301 . . . . 0.0 108.041 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -32.01 72.31 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.681 177.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 746' ' ' ILE . 0.7 OUTLIER -57.54 -55.7 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.4 m -64.35 -38.89 83.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.594 0.711 . . . . 0.0 111.066 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.15 -41.64 97.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.602 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.91 -43.42 83.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.223 0.535 . . . . 0.0 111.231 -178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.586 HD23 ' ND2' ' B' ' 750' ' ' ASN . 2.0 tp -87.38 -12.91 44.9 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.966 0.412 . . . . 0.0 112.035 -179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -63.17 -39.67 98.22 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 25.8 ptt85 -76.96 151.04 35.85 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.335 0.588 . . . . 0.0 110.809 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.468 0.459 0 CA-C-O 117.847 -1.073 . . . . 0.0 110.722 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.785 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.6 tp . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.453 HD22 ' N ' ' B' ' 661' ' ' LEU . 3.9 mm? 58.05 106.31 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.315 0.579 . . . . 0.0 110.196 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.15 177.97 4.6 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.939 0.876 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.498 ' C ' HD23 ' B' ' 663' ' ' LEU . 10.1 tt -46.19 -53.76 9.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.691 0.758 . . . . 0.0 111.48 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -65.41 -29.61 70.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.578 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -76.45 -44.4 35.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.913 0.387 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -59.08 -46.1 89.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.634 0.73 . . . . 0.0 110.085 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.08 -21.64 66.61 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.228 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 4.9 m -70.35 -36.25 74.09 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.822 -0.549 . . . . 0.0 111.217 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.581 HD12 ' CG2' ' B' ' 675' ' ' ILE . 3.5 mm? -60.74 -23.82 65.24 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.992 -0.443 . . . . 0.0 111.196 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -59.86 -23.02 63.07 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.764 -0.585 . . . . 0.0 111.111 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -88.14 -27.73 21.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.123 0.487 . . . . 0.0 111.265 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -57.44 -50.87 71.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.528 0.68 . . . . 0.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.64 29.94 14.99 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.136 0.494 . . . . 0.0 111.269 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -144.11 -61.47 0.39 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.671 -0.643 . . . . 0.0 111.075 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.581 ' CG2' HD12 ' B' ' 669' ' ' LEU . 5.9 tp -67.92 -37.78 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 121.323 0.582 . . . . 0.0 110.33 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.8 m -52.98 -34.55 56.56 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.758 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -69.16 -50.47 47.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.886 -0.509 . . . . 0.0 111.368 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.74 -42.17 95.4 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.0 tp -65.97 -35.74 81.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.94 0.4 . . . . 0.0 110.859 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -101.27 6.56 42.92 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.58 -21.15 9.29 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 121.71 -0.619 . . . . 0.0 110.471 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.0 tp -62.16 -35.53 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.771 0.796 . . . . 0.0 109.982 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -53.21 -47.36 69.0 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.622 -0.674 . . . . 0.0 109.972 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.443 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.8 mp -69.21 -37.91 76.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 122.246 1.022 . . . . 0.0 108.394 177.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.427 ' O ' HG23 ' B' ' 689' ' ' VAL . 11.9 t80 -59.73 -33.89 72.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.674 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.5 ' CG2' HD12 ' C' ' 686' ' ' ILE . 1.4 mp -60.49 -41.98 89.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 86.2 mt -62.41 -36.95 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.15 -37.54 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.529 ' O ' HD11 ' B' ' 692' ' ' LEU . 93.3 t -54.12 -38.79 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 O-C-N 121.723 -0.611 . . . . 0.0 109.447 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.64 -27.15 57.61 Favored Glycine 0 CA--C 1.546 1.995 0 O-C-N 121.902 -0.499 . . . . 0.0 112.078 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 25.7 m -60.77 -47.12 87.76 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.613 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.7 -32.59 70.65 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.528 -0.733 . . . . 0.0 111.482 -178.004 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.613 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.37 -41.66 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 O-C-N 121.605 -0.684 . . . . 0.0 109.662 -178.527 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.94 -32.17 83.34 Favored Glycine 0 CA--C 1.538 1.513 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.84 -37.08 63.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.3 1.048 . . . . 0.0 109.345 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.63 ' HG3' HD11 ' A' ' 693' ' ' ILE . 26.6 mmt180 -55.58 -28.28 54.12 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.692 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 79.2 mt -58.77 -36.21 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 O-C-N 121.423 -0.798 . . . . 0.0 108.914 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -30.29 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 O-C-N 121.674 -0.641 . . . . 0.0 110.123 177.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 5.5 m-85 -56.36 -31.01 63.38 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 121.828 -0.545 . . . . 0.0 109.871 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.89 -37.57 76.89 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.86 -40.59 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.167 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 176.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.3 tp -55.6 -37.21 67.82 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.975 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.5 m -62.37 -40.77 97.51 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.178 0.513 . . . . 0.0 110.821 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.78 -41.05 94.79 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 122.069 0.938 . . . . 0.0 109.265 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.649 ' HA ' HD13 ' B' ' 748' ' ' LEU . 89.8 t -69.68 -43.57 80.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.556 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HB2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.77 -36.41 82.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.078 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -67.19 -47.75 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.151 -0.968 . . . . 0.0 110.375 -178.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.555 ' CG1' HD11 ' B' ' 748' ' ' LEU . 2.6 t -77.12 -46.29 28.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -73.8 -43.17 59.63 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' B' ' 706' ' ' ASN . 31.5 mt-30 -102.01 -21.58 14.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -175.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . 0.444 ' HA3' HD11 ' B' ' 715' ' ' LEU . . . 109.43 136.32 7.53 Favored Glycine 0 CA--C 1.534 1.235 0 N-CA-C 109.699 -1.361 . . . . 0.0 109.699 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . 0.679 ' O ' HD22 ' A' ' 704' ' ' LEU . 2.1 p90 -75.4 -67.89 0.61 Allowed 'General case' 0 CA--C 1.557 1.24 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 1.7 p -65.54 159.6 66.42 Favored Pre-proline 0 N--CA 1.47 0.535 0 O-C-N 120.628 -1.295 . . . . 0.0 110.516 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -37.57 133.11 0.62 Allowed 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.996 1.798 . . . . 0.0 111.847 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.516 HD22 ' N ' ' B' ' 715' ' ' LEU . 2.0 mm? -94.16 -20.35 19.95 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.503 ' C ' ' O ' ' B' ' 715' ' ' LEU . 97.3 p . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 122.279 1.037 . . . . 0.0 112.819 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 121.47 0.653 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -71.03 -26.61 63.18 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.298 0.57 . . . . 0.0 111.284 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -56.23 -7.03 0.31 Allowed 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.447 ' O ' HG13 ' B' ' 746' ' ' ILE . 3.6 ttm180 -55.73 -38.99 70.51 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.515 -0.741 . . . . 0.0 110.912 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -58.54 -43.94 89.45 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.339 0.59 . . . . 0.0 109.664 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -71.42 -39.78 70.87 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.141 0.496 . . . . 0.0 110.468 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.84 -23.76 46.32 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.982 HG23 HG23 ' A' ' 781' ' ' ILE . 48.6 mt -52.43 -32.47 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -28.36 67.57 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 121.165 0.507 . . . . 0.0 110.452 179.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.649 HD13 ' HA ' ' B' ' 705' ' ' VAL . 45.4 mt -56.24 -35.7 67.67 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.497 0.555 . . . . 0.0 112.497 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.48 -54.11 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.586 ' ND2' HD23 ' A' ' 785' ' ' LEU . 4.4 m-80 -72.46 -18.77 61.65 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.668 0.746 . . . . 0.0 110.073 175.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.4 37.26 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.377 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 83.8 p -59.21 -39.65 83.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 117.787 0.793 . . . . 0.0 110.052 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.0 tp -69.66 -51.17 37.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.8 0.81 . . . . 0.0 109.649 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.13 73.27 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.408 0.623 . . . . 0.0 111.366 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.494 HD21 HE22 ' C' ' 710' ' ' GLN . 10.5 tt -59.76 -45.2 92.97 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 120.976 0.417 . . . . 0.0 110.787 -178.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 53.7 mt -70.4 -33.7 55.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.5 0.667 . . . . 0.0 109.55 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.1 -30.28 68.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.754 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -55.61 -47.97 75.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.409 -0.807 . . . . 0.0 110.086 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -70.73 -45.25 65.22 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 28.1 mt -69.23 -46.28 67.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.653 0.74 . . . . 0.0 112.535 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -69.06 -40.12 78.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.682 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 15.4 t -63.92 -45.1 90.77 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.911 0.862 . . . . 0.0 110.599 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.612 ' O ' HD22 ' B' ' 774' ' ' LEU . 3.6 tp -63.83 -51.84 62.88 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.872 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.1 -49.23 5.07 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.878 -0.514 . . . . 0.0 111.922 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . 0.536 HD13 ' O ' ' B' ' 765' ' ' LEU . 3.4 tm? 69.45 93.54 0.08 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 122.22 1.009 . . . . 0.0 109.81 -178.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 58.6 t80 56.54 -88.51 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.915 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 5.2 m -67.96 134.76 51.31 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.283 -0.886 . . . . 0.0 111.246 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.6 -33.95 69.46 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.001 0.429 . . . . 0.0 109.981 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -54.46 -38.49 66.43 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.154 0.978 . . . . 0.0 108.956 178.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.85 -29.6 60.12 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.452 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.426 HD11 HD23 ' B' ' 763' ' ' LEU . 7.3 tt -59.25 -41.28 88.39 Favored 'General case' 0 C--N 1.343 0.296 0 O-C-N 121.794 -0.566 . . . . 0.0 109.841 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . 0.407 ' O ' HD12 ' B' ' 776' ' ' LEU . 70.8 mtp85 -59.95 -39.47 85.67 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -64.22 -45.65 87.31 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.235 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.612 HD22 ' O ' ' B' ' 763' ' ' LEU . 5.9 mp -66.6 -37.8 85.65 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 121.835 0.826 . . . . 0.0 110.262 178.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.527 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -62.83 -36.65 83.92 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.646 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . 0.407 HD12 ' O ' ' B' ' 772' ' ' ARG . 0.3 OUTLIER -73.67 -42.21 61.64 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.848 -0.533 . . . . 0.0 111.996 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.89 -37.44 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 121.634 -0.666 . . . . 0.0 110.468 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . . . . . . . . . 13.1 p -63.32 -44.99 99.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.886 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.775 ' O ' HG22 ' B' ' 782' ' ' VAL . 7.2 t -64.06 -35.72 81.67 Favored 'General case' 0 C--N 1.351 0.642 0 O-C-N 121.577 -0.702 . . . . 0.0 111.125 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -31.47 71.94 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.983 -0.448 . . . . 0.0 111.622 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 76.5 mt -67.88 -36.78 76.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 O-C-N 121.759 -0.588 . . . . 0.0 110.907 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.775 HG22 ' O ' ' B' ' 779' ' ' THR . 6.9 m -61.07 -39.0 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.852 -0.53 . . . . 0.0 111.984 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.4 -41.58 93.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.628 -0.67 . . . . 0.0 111.043 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.0 -42.17 99.78 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.619 0.723 . . . . 0.0 110.174 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.433 HD23 ' HB3' ' C' ' 750' ' ' ASN . 15.0 tp -82.36 -17.38 45.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.413 0.625 . . . . 0.0 111.624 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.37 -46.09 22.22 Favored Glycine 0 CA--C 1.531 1.074 0 O-C-N 121.797 -0.564 . . . . 0.0 112.16 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 95.5 5.29 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.488 0.661 . . . . 0.0 110.524 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.127 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.499 HD12 ' C ' ' C' ' 660' ' ' LEU . 4.0 pp . . . . . 0 N--CA 1.496 1.827 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.0 143.28 50.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.267 0.556 . . . . 0.0 110.63 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -172.44 176.44 3.3 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.086 0.469 . . . . 0.0 110.05 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 20.7 tp -54.59 -44.0 72.64 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.767 0.794 . . . . 0.0 109.957 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.88 -33.52 76.22 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.778 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -79.19 -40.32 31.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.185 0.517 . . . . 0.0 110.736 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -70.78 -46.33 63.09 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 110.318 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.72 -22.26 66.59 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.442 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 36.3 t -68.1 -35.56 78.36 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.1 0.476 . . . . 0.0 111.441 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -34.47 73.35 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.117 0.484 . . . . 0.0 111.197 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 64.9 m95 -59.83 -27.93 67.04 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.117 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -77.73 -20.1 54.07 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.081 -0.387 . . . . 0.0 112.033 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -67.46 -45.07 77.04 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.673 0.749 . . . . 0.0 110.348 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 53.89 29.26 9.6 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.028 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -144.05 -75.8 0.24 Allowed 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.49 -0.756 . . . . 0.0 112.497 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.674 HD13 ' CZ3' ' C' ' 678' ' ' TRP . 0.6 OUTLIER -68.23 -36.67 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.62 -0.675 . . . . 0.0 111.221 -178.571 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 25.3 m -51.62 -33.09 31.58 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.16 -0.337 . . . . 0.0 110.963 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -56.33 -47.89 77.85 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.674 ' CZ3' HD13 ' C' ' 675' ' ' ILE . 0.0 OUTLIER -64.87 -43.43 92.96 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 177.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.51 ' O ' HD23 ' C' ' 679' ' ' LEU . 0.9 OUTLIER -58.87 -40.14 83.49 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -97.71 -40.39 8.6 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -69.18 -19.79 63.99 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.704 -0.623 . . . . 0.0 112.015 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.67 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.2 pp -60.63 -36.7 72.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.67 ' N ' HD12 ' C' ' 682' ' ' ILE . 1.6 ttt-85 -53.69 -45.21 70.29 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 121.861 0.839 . . . . 0.0 109.023 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 36.3 mm -62.38 -43.13 97.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 122.4 1.095 . . . . 0.0 108.898 177.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.534 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.7 OUTLIER -60.47 -27.59 67.67 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.125 -178.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.5 HD12 ' CG2' ' B' ' 686' ' ' ILE . 16.5 mm -60.11 -46.48 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 O-C-N 121.974 -0.454 . . . . 0.0 109.889 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.02 -41.4 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.511 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.2 mt -59.79 -37.59 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.951 179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.534 HG23 ' O ' ' C' ' 685' ' ' PHE . 79.6 t -54.78 -45.32 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.33 -38.76 62.96 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 109.039 -1.625 . . . . 0.0 109.039 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -37.93 84.65 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 122.09 0.948 . . . . 0.0 109.824 177.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.23 -46.29 88.87 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 113.166 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -61.3 -41.82 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.401 -0.812 . . . . 0.0 109.415 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.95 73.15 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.407 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.4 tt -54.87 -37.66 66.55 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.559 -0.965 . . . . 0.0 110.196 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -55.91 -28.68 57.89 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 116.789 2.144 . . . . 0.0 116.789 -177.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -36.85 62.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-N 121.338 1.881 . . . . 0.0 111.183 -175.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.4 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.8 p -62.55 -30.26 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 O-C-N 121.448 -0.782 . . . . 0.0 111.014 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -56.29 -31.12 63.36 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.75 -0.594 . . . . 0.0 110.04 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.18 -37.79 78.24 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.73 -43.64 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tp -61.24 -37.71 84.06 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.209 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 61.9 m -62.52 -36.23 81.94 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.374 0.607 . . . . 0.0 110.371 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -62.91 -47.01 85.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.483 1.135 . . . . 0.0 108.494 178.544 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.72 -44.26 98.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.783 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -62.57 -35.79 80.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.281 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -61.32 -50.28 73.59 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.473 -0.767 . . . . 0.0 110.655 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' A' ' 713' ' ' SER . 0.6 OUTLIER -77.33 -45.02 30.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.824 0.821 . . . . 0.0 111.782 -178.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -73.83 -33.37 64.12 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.494 HE22 HD21 ' B' ' 755' ' ' LEU . 7.4 tt0 -102.17 -15.49 16.65 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 91.83 133.73 6.12 Favored Glycine 0 CA--C 1.542 1.751 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -87.7 -36.72 17.23 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.764 -0.845 . . . . 0.0 113.102 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.53 149.35 35.65 Favored Pre-proline 0 N--CA 1.469 0.483 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.961 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . 0.443 ' CD ' HG21 ' B' ' 708' ' ' VAL . 16.9 Cg_exo -36.71 92.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.501 2.134 . . . . 0.0 112.704 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.97 11.03 1.94 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.492 0.663 . . . . 0.0 110.903 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -72.67 -38.31 67.66 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.328 0.585 . . . . 0.0 111.528 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.57 -7.49 53.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.493 ' O ' HD12 ' C' ' 746' ' ' ILE . 0.0 OUTLIER -65.87 -35.34 80.38 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.695 -0.628 . . . . 0.0 111.411 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -58.04 -41.19 82.74 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 109.786 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.4 68.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-O 121.214 0.531 . . . . 0.0 110.496 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . 0.585 ' O ' HD22 ' C' ' 748' ' ' LEU . 83.8 p -67.04 -43.09 83.64 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.637 -0.665 . . . . 0.0 110.178 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.493 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.8 mp -55.43 -23.9 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.945 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . 0.512 ' HA ' HD21 ' C' ' 750' ' ' ASN . 6.9 mtt180 -60.01 -15.64 24.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.885 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.585 HD22 ' O ' ' C' ' 745' ' ' SER . 1.5 pt? -55.38 -31.77 62.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.972 -0.455 . . . . 0.0 110.949 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 45.7 t -55.73 -54.9 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.512 HD21 ' HA ' ' C' ' 747' ' ' ARG . 1.1 p30 -72.39 -23.63 61.13 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.766 0.793 . . . . 0.0 109.761 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.75 -21.76 44.74 Favored Glycine 0 C--N 1.342 0.899 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.012 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 19.3 m -63.07 -42.24 99.62 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.943 -0.739 . . . . 0.0 109.894 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.7 tp -69.32 -44.86 70.85 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.422 0.63 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.78 -35.63 79.02 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.872 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.447 HD11 ' HG ' ' C' ' 704' ' ' LEU . 8.8 tt -61.33 -45.3 95.02 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.216 0.531 . . . . 0.0 111.241 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 44.7 mm -71.67 -40.99 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.118 0.485 . . . . 0.0 110.38 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.56 -41.11 76.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -55.84 -35.89 66.92 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.346 -0.847 . . . . 0.0 110.54 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -70.37 -45.47 66.0 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.762 0.791 . . . . 0.0 111.156 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 20.8 mt -69.61 -46.07 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.676 0.75 . . . . 0.0 112.249 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . 0.542 ' O ' HD13 ' C' ' 765' ' ' LEU . 1.5 ttp180 -68.81 -27.5 65.92 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.543 -177.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.9 m -63.96 -43.96 94.22 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.447 0.641 . . . . 0.0 111.173 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.73 -54.66 14.76 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 3.0 p -97.86 -18.26 18.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . 0.545 HD22 ' N ' ' C' ' 765' ' ' LEU . 3.3 mm? 49.67 78.86 0.09 Allowed 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.393 -0.817 . . . . 0.0 109.744 -177.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 69.9 t80 65.9 125.0 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.234 1.016 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 23.06 88.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 178.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . 0.437 ' CZ ' HD22 ' C' ' 771' ' ' LEU . 1.1 m-85 22.63 -146.72 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.759 1.223 . . . . 0.0 114.028 176.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 74.26 -64.56 0.38 Allowed 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.201 -0.937 . . . . 0.0 109.398 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.26 69.77 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.098 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' C' ' 768' ' ' TYR . 39.1 tp -59.48 -36.93 76.96 Favored 'General case' 0 C--N 1.348 0.543 0 O-C-N 121.803 -0.561 . . . . 0.0 109.731 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -42.96 82.17 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' C' ' 776' ' ' LEU . 23.6 m-20 -69.38 -34.4 74.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.556 176.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.524 HD13 ' C ' ' C' ' 774' ' ' LEU . 3.3 tm? -61.08 -41.2 96.21 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.749 -0.594 . . . . 0.0 110.868 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.45 -38.3 83.74 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . 0.464 HD12 ' N ' ' C' ' 777' ' ' ILE . 3.3 pp -74.01 -28.45 61.45 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.656 -0.652 . . . . 0.0 111.822 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.464 ' N ' HD12 ' C' ' 776' ' ' LEU . 0.6 OUTLIER -69.26 -39.14 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 O-C-N 121.467 -0.77 . . . . 0.0 110.682 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.702 ' O ' HG22 ' C' ' 781' ' ' ILE . 12.3 m -66.36 -46.35 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.877 -178.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.849 ' O ' HG22 ' C' ' 782' ' ' VAL . 9.8 t -64.21 -37.5 87.71 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.974 -0.454 . . . . 0.0 111.815 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.6 72.59 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.148 -0.345 . . . . 0.0 111.567 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.718 HD13 HG22 ' A' ' 746' ' ' ILE . 8.9 tt -55.03 -39.95 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.546 -0.721 . . . . 0.0 111.233 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.849 HG22 ' O ' ' C' ' 779' ' ' THR . 20.3 m -60.16 -38.29 76.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.276 -0.569 . . . . 0.0 111.917 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -64.51 -45.21 88.21 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.708 -0.62 . . . . 0.0 111.531 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . 0.459 ' C ' HD12 ' C' ' 784' ' ' LEU . 0.3 OUTLIER -70.29 -36.52 74.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.653 0.74 . . . . 0.0 109.997 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.64 -36.88 85.68 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.201 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -47.61 -34.0 9.53 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 111.294 -0.723 . . . . 0.0 111.294 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -102.27 151.91 21.67 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 122.116 -0.637 . . . . 0.0 110.209 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.254 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.663 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.5 tp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.755 0.788 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 76.0 mt 52.75 81.03 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.046 0.927 . . . . 0.0 111.209 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.75 177.82 8.44 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.67 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.3 OUTLIER -54.41 -34.38 61.22 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.253 0.549 . . . . 0.0 110.15 179.444 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -75.79 -35.54 60.04 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -80.1 -41.2 26.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.259 0.552 . . . . 0.0 110.676 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -67.96 -43.62 78.62 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.298 0.57 . . . . 0.0 110.281 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.54 -29.52 63.65 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.722 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 36.7 t -69.77 -30.56 68.16 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 110.745 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.423 HD23 HG23 ' A' ' 676' ' ' THR . 17.8 tp -61.02 -31.5 71.13 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.843 0.354 . . . . 0.0 111.173 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.58 -18.3 39.98 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.921 -0.487 . . . . 0.0 111.702 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -84.02 -16.08 45.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.921 -0.487 . . . . 0.0 111.807 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -60.6 -50.22 74.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.341 0.591 . . . . 0.0 110.88 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 55.3 t80 56.55 44.42 24.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.005 0.907 . . . . 0.0 110.982 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -153.59 -80.61 0.09 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.8 -0.562 . . . . 0.0 110.561 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 11.2 tt -68.13 -35.71 72.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.841 -0.537 . . . . 0.0 111.973 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.423 HG23 HD23 ' A' ' 669' ' ' LEU . 4.1 m -50.22 -33.34 19.13 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -174.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -63.26 -50.42 70.23 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.331 0.969 . . . . 0.0 109.001 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.411 ' CD1' ' C ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -66.07 -44.37 84.72 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.577 0.704 . . . . 0.0 110.123 177.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.425 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -63.67 -37.08 86.0 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -92.11 -44.51 8.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -73.38 -0.82 15.89 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.44 -36.37 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 121.296 -0.878 . . . . 0.0 109.622 178.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -53.77 -47.58 70.57 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.96 0.41 . . . . 0.0 110.874 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -68.43 -31.98 53.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -33.61 76.19 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 1.036 HD12 HG21 ' C' ' 686' ' ' ILE . 8.9 mm -60.83 -49.51 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.2 0.524 . . . . 0.0 109.991 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.0 mt -61.48 -38.5 80.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.09 -37.16 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.245 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 74.9 t -54.2 -39.65 43.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.7 -41.73 97.6 Favored Glycine 0 CA--C 1.534 1.24 0 N-CA-C 108.961 -1.655 . . . . 0.0 108.961 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.2 m -61.77 -37.9 86.04 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.777 0.798 . . . . 0.0 109.766 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.88 -46.09 88.65 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.879 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.624 HG13 HG22 ' B' ' 693' ' ' ILE . 0.3 OUTLIER -68.38 -40.1 81.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.538 179.538 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.17 -26.73 64.07 Favored Glycine 0 CA--C 1.54 1.652 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.41 -37.33 85.39 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.691 1.234 . . . . 0.0 109.332 177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 21.5 mmt180 -55.9 -28.31 56.11 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.019 -178.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.1 OUTLIER -59.25 -37.12 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.03 -1.043 . . . . 0.0 109.869 -177.225 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.774 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.1 p -67.41 -30.57 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 121.547 -0.721 . . . . 0.0 109.952 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.3 OUTLIER -55.55 -28.79 56.94 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.232 0.539 . . . . 0.0 109.713 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.06 72.01 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.774 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -61.01 -35.93 68.76 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -38.0 72.81 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.0 m -64.18 -36.7 84.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.748 0.785 . . . . 0.0 109.707 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.569 HD22 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -61.98 -44.11 97.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 122.495 1.14 . . . . 0.0 108.636 178.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.888 HG22 HD12 ' A' ' 748' ' ' LEU . 88.0 t -65.45 -42.03 92.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.484 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -62.61 -37.08 84.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.574 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.569 HH22 HD22 ' A' ' 704' ' ' LEU . 21.4 ttm105 -61.59 -46.93 87.77 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 122.096 0.951 . . . . 0.0 110.334 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 1.3 t -75.77 -44.04 39.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.15 0.976 . . . . 0.0 109.833 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -72.88 -14.89 61.58 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -20.69 18.2 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.297 -0.877 . . . . 0.0 111.962 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.9 24.96 7.03 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.416 ' CD1' ' CZ ' ' C' ' 707' ' ' ARG . 0.1 OUTLIER 59.07 -103.55 0.17 Allowed 'General case' 0 CA--C 1.562 1.406 0 O-C-N 121.956 -0.732 . . . . 0.0 111.559 179.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 2.2 p -79.39 159.52 72.2 Favored Pre-proline 0 C--N 1.349 0.558 0 O-C-N 120.931 -1.106 . . . . 0.0 110.013 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.511 ' HD3' HD12 ' C' ' 748' ' ' LEU . 72.2 Cg_exo -41.72 110.82 0.15 Allowed 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.574 1.516 . . . . 0.0 112.514 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.94 -18.97 13.56 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 122.072 -0.392 . . . . 0.0 111.797 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.546 0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 111.044 -179.802 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.77 0.795 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -26.52 62.38 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.69 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -13.48 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.603 HH11 HG21 ' C' ' 777' ' ' ILE . 20.0 ttp-105 -73.79 -46.82 43.08 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.358 -0.839 . . . . 0.0 110.148 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.468 ' O ' HG23 ' C' ' 781' ' ' ILE . 1.3 p30 -62.79 -34.68 77.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 122.52 1.152 . . . . 0.0 109.645 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . 0.669 ' O ' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -71.8 -37.87 70.34 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.645 179.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.3 t -70.02 -39.7 75.65 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.626 -0.671 . . . . 0.0 112.654 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.797 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.0 OUTLIER -66.36 -41.26 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-O 116.367 -1.778 . . . . 0.0 115.28 -176.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.752 ' HB3' HD23 ' C' ' 785' ' ' LEU . 1.6 tmt_? -78.37 -11.51 59.95 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 123.568 2.895 . . . . 0.0 109.212 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.888 HD12 HG22 ' A' ' 705' ' ' VAL . 3.5 tm? -55.78 -20.54 15.32 Favored 'General case' 0 C--N 1.375 1.698 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 172.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 746' ' ' ILE . 1.8 p -54.67 -50.41 60.14 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 177.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.447 ' HB2' ' HD3' ' A' ' 747' ' ' ARG . 1.3 m-80 -71.99 -28.17 63.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.522 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.4 -18.65 22.92 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.409 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 77.6 p -56.63 -36.77 69.85 Favored 'General case' 0 C--N 1.347 0.458 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 33.7 tp -61.53 -47.96 83.19 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.74 -34.59 71.54 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.768 178.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.46 HD22 HG12 ' A' ' 701' ' ' VAL . 0.9 OUTLIER -59.01 -44.68 91.72 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.725 -0.61 . . . . 0.0 111.38 -177.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.36 -32.63 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.43 -30.67 68.65 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.019 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 4.4 m-20 -58.02 -46.99 84.4 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.94 0.876 . . . . 0.0 108.814 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.71 -42.24 70.86 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.505 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 19.3 mt -68.25 -33.39 74.3 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -70.65 -27.43 64.03 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -177.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 m -75.82 -45.35 36.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.544 0.688 . . . . 0.0 110.819 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.64 ' HA ' HD13 ' A' ' 774' ' ' LEU . 7.0 mp -68.5 -56.79 7.16 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.41 -49.53 4.21 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.085 0.945 . . . . 0.0 112.301 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.467 ' C ' HD13 ' A' ' 765' ' ' LEU . 2.9 tm? 91.32 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.354 1.462 . . . . 0.0 110.626 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -114.11 -68.07 0.95 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.648 -0.657 . . . . 0.0 111.266 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 24.8 p -91.45 158.8 16.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -78.31 -18.26 55.46 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.122 0.487 . . . . 0.0 111.015 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -72.36 -35.3 68.48 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.589 0.709 . . . . 0.0 109.345 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -57.85 -30.02 65.45 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.243 0.544 . . . . 0.0 110.68 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -34.82 73.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -56.84 -37.58 71.47 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.599 0.714 . . . . 0.0 109.582 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.31 -48.58 72.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.83 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.683 HD12 ' NE ' ' B' ' 742' ' ' ARG . 5.8 tt -60.52 -38.48 84.53 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.653 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.59 -36.97 74.83 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.4 -0.813 . . . . 0.0 110.641 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.23 -45.31 48.91 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.99 -0.444 . . . . 0.0 112.069 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.31 -37.25 79.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.685 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.447 HG22 HG12 ' B' ' 746' ' ' ILE . 38.5 t -56.28 -46.79 81.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.766 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.795 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.2 p -64.13 -35.37 80.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.606 0.717 . . . . 0.0 109.854 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -65.3 -38.4 90.08 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.129 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.407 ' CD1' HD13 ' B' ' 746' ' ' ILE . 78.4 mt -59.29 -37.07 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 O-C-N 122.078 -0.389 . . . . 0.0 111.399 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.795 HG22 ' O ' ' A' ' 779' ' ' THR . 5.7 m -54.39 -38.34 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 121.331 -0.856 . . . . 0.0 110.431 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -64.57 -42.51 95.61 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.399 0.619 . . . . 0.0 110.768 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.6 tt -70.22 -43.94 69.63 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.399 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.601 HD22 ' ND2' ' B' ' 750' ' ' ASN . 0.1 OUTLIER -69.84 -21.86 63.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.861 -0.525 . . . . 0.0 111.057 -179.201 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -43.4 -28.2 0.9 Allowed Glycine 0 CA--C 1.538 1.482 0 O-C-N 122.13 -0.356 . . . . 0.0 112.237 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 152.17 24.71 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.022 -0.693 . . . . 0.0 110.779 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 118.027 -0.987 . . . . 0.0 111.488 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.67 ' N ' HD12 ' A' ' 663' ' ' LEU . 10.6 mt . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.564 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.4 mm? 60.25 110.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.342 0.591 . . . . 0.0 110.239 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -177.2 169.4 2.29 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.633 HD12 HD13 ' C' ' 660' ' ' LEU . 3.4 tt -51.21 -38.6 53.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.402 0.62 . . . . 0.0 110.552 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -70.96 -37.16 72.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.336 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -70.31 -47.85 59.3 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.364 0.602 . . . . 0.0 110.775 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -60.22 -45.4 93.32 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.435 0.636 . . . . 0.0 110.182 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.8 -25.68 65.71 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.311 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -63.29 -37.75 88.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.216 0.531 . . . . 0.0 111.136 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 45.0 mt -60.13 -30.28 69.18 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.015 0.436 . . . . 0.0 111.718 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -59.56 -25.15 64.31 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.211 0.529 . . . . 0.0 110.695 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -81.14 -22.03 39.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.091 0.472 . . . . 0.0 111.328 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -70.01 -49.69 48.86 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.649 0.737 . . . . 0.0 110.702 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.6 t80 59.78 49.69 7.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.02 0.914 . . . . 0.0 111.031 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -158.21 -70.37 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.867 -0.52 . . . . 0.0 110.855 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.19 -37.18 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.129 0.49 . . . . 0.0 110.912 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.7 m -52.34 -33.74 44.13 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -65.28 -50.86 64.13 Favored 'General case' 0 C--N 1.345 0.379 0 O-C-N 121.495 -0.753 . . . . 0.0 110.753 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.753 ' O ' HG23 ' B' ' 682' ' ' ILE . 1.2 t90 -65.84 -44.03 86.75 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.854 0.835 . . . . 0.0 109.094 177.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.65 -35.73 81.5 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.25 -28.1 12.83 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -82.6 -6.04 59.13 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.432 -0.792 . . . . 0.0 112.155 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.753 HG23 ' O ' ' B' ' 678' ' ' TRP . 3.3 pt -60.88 -36.74 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.782 -0.574 . . . . 0.0 111.038 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -53.39 -47.08 69.82 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.075 0.464 . . . . 0.0 110.291 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -68.99 -34.0 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.4 OUTLIER -60.56 -27.62 67.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.38 179.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.797 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -60.75 -45.53 97.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.256 0.55 . . . . 0.0 109.537 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 71.6 mt -62.63 -40.87 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' B' ' 685' ' ' PHE . 32.6 mt -58.61 -37.53 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.47 ' O ' HD12 ' B' ' 692' ' ' LEU . 62.8 t -57.77 -43.35 83.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.63 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.71 -26.71 47.4 Favored Glycine 0 CA--C 1.544 1.845 0 O-C-N 121.579 -0.701 . . . . 0.0 111.926 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 18.6 m -60.52 -45.82 92.41 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.47 HD12 ' O ' ' B' ' 689' ' ' VAL . 0.0 OUTLIER -59.62 -32.61 70.58 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 119.674 1.124 . . . . 0.0 111.586 -177.565 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.624 HG22 HG13 ' A' ' 693' ' ' ILE . 0.9 OUTLIER -57.42 -44.98 85.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.579 -0.701 . . . . 0.0 109.628 -178.187 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.09 67.66 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.422 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.8 OUTLIER -60.17 -37.4 80.04 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 122.018 0.913 . . . . 0.0 110.424 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.5 ' N ' ' HD2' ' B' ' 696' ' ' ARG . 8.4 mpt_? -54.85 -28.48 50.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.077 0.951 . . . . 0.0 113.259 -178.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -36.4 62.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 O-C-N 120.953 -1.092 . . . . 0.0 109.204 -178.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.422 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.25 -30.22 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 O-C-N 121.499 -0.751 . . . . 0.0 110.413 177.379 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 6.6 m-85 -56.29 -31.09 63.33 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 121.861 -0.524 . . . . 0.0 109.861 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.67 77.23 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -42.15 89.63 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.3 tp -58.64 -38.76 78.8 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.423 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -62.92 -35.17 79.21 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.375 0.607 . . . . 0.0 110.414 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -42.32 95.0 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 122.191 0.996 . . . . 0.0 108.965 178.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.476 HG22 HD13 ' B' ' 748' ' ' LEU . 72.0 t -66.77 -45.17 88.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 122.192 0.996 . . . . 0.0 108.783 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.458 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.4 m-80 -62.86 -36.43 83.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.419 ' CZ ' ' HG2' ' C' ' 707' ' ' ARG . 23.2 ttm180 -69.0 -50.13 51.65 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.741 0.781 . . . . 0.0 111.151 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' C' ' 713' ' ' SER . 1.0 OUTLIER -77.95 -44.67 28.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.148 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -59.75 -45.69 91.43 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.597 ' O ' HD12 ' B' ' 715' ' ' LEU . 3.8 pt20 -105.08 -24.11 12.83 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 140.41 164.96 10.11 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -98.5 -65.49 0.96 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 121.899 -0.765 . . . . 0.0 111.511 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 38.6 p -72.56 159.47 85.28 Favored Pre-proline 0 CA--C 1.532 0.282 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.299 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.593 ' HB3' HD23 ' A' ' 748' ' ' LEU . 38.5 Cg_exo -34.59 125.02 0.19 Allowed 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.269 1.979 . . . . 0.0 113.352 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.597 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.2 tt -87.5 -20.4 26.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.42 ' C ' ' O ' ' B' ' 715' ' ' LEU . 27.2 t . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 122.131 0.967 . . . . 0.0 113.175 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.16 0.981 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -57.93 -26.33 62.1 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.401 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.4 -8.67 0.36 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.683 ' NE ' HD12 ' A' ' 774' ' ' LEU . 4.8 ptt-85 -78.18 -26.65 47.73 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.296 -0.877 . . . . 0.0 111.453 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -58.14 -45.89 86.6 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.97 -0.456 . . . . 0.0 110.095 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.97 -34.76 69.22 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.245 0.545 . . . . 0.0 109.991 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 1.1 p -56.79 -33.7 66.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.357 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.447 HG12 HG22 ' A' ' 778' ' ' VAL . 0.8 OUTLIER -55.63 -17.95 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.37 177.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.461 ' HG3' HD21 ' A' ' 785' ' ' LEU . 15.5 ttm180 -58.81 -25.81 63.52 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.507 ' C ' HD12 ' B' ' 748' ' ' LEU . 4.4 pp -55.43 -23.29 24.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.009 0.433 . . . . 0.0 110.593 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 746' ' ' ILE . 74.7 t -55.41 -53.93 30.62 Favored 'Isoleucine or valine' 0 C--N 1.348 0.537 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.601 ' ND2' HD22 ' A' ' 785' ' ' LEU . 5.0 m-80 -72.22 -20.11 61.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.355 176.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.45 -20.52 37.91 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 16.3 m -59.04 -41.83 88.8 Favored 'General case' 0 C--O 1.236 0.353 0 O-C-N 121.871 -0.782 . . . . 0.0 109.804 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -65.78 -50.5 64.48 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.552 0.692 . . . . 0.0 110.09 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.41 -35.4 79.1 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.188 0.518 . . . . 0.0 111.641 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.426 HD21 HE22 ' C' ' 710' ' ' GLN . 7.1 tt -59.6 -45.3 92.32 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.909 -0.495 . . . . 0.0 110.857 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 60.0 mt -63.61 -36.56 76.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.808 0.813 . . . . 0.0 108.857 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.44 -30.28 69.13 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.584 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' C' ' 710' ' ' GLN . 95.6 m-20 -55.34 -49.4 72.33 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.715 0.769 . . . . 0.0 109.817 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -70.53 -44.69 67.01 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.0 -29.68 70.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.9 mtm180 -82.05 -45.47 15.23 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -42.68 65.13 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.683 0.754 . . . . 0.0 110.46 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.466 HD23 HD11 ' B' ' 771' ' ' LEU . 1.3 tp -60.83 -53.84 52.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.488 -178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 12.4 p -97.89 -49.48 4.78 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.427 0.632 . . . . 0.0 112.112 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 2.0 tt 64.9 104.86 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.995 0.902 . . . . 0.0 111.711 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.41 -76.06 0.06 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.84 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 13.3 m -112.78 172.14 7.11 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.429 -0.794 . . . . 0.0 112.071 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -37.54 30.17 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.116 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -53.08 -38.99 63.0 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.275 1.036 . . . . 0.0 109.027 178.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 18.7 tpt85 -61.13 -29.76 69.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.007 178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.466 HD11 HD23 ' B' ' 763' ' ' LEU . 10.4 tt -59.75 -33.08 71.2 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.854 -0.529 . . . . 0.0 110.537 -178.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -56.66 -32.89 65.82 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -47.67 85.32 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.669 HD12 ' HE ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -61.66 -39.6 91.97 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.723 0.773 . . . . 0.0 110.142 179.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.587 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.9 OUTLIER -62.68 -43.07 99.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.085 0.469 . . . . 0.0 111.046 -178.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 65.2 mt -74.01 -41.15 62.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 1.9 pp -70.26 -37.22 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 121.765 -0.585 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.537 HG23 ' O ' ' B' ' 774' ' ' LEU . 40.7 t -61.25 -46.08 97.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 O-C-N 121.503 -0.748 . . . . 0.0 109.786 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.833 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.0 t -63.77 -41.99 97.87 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 121.766 -0.583 . . . . 0.0 112.085 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -31.86 72.12 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.84 -0.537 . . . . 0.0 111.756 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 60.0 mt -62.73 -36.47 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 122.03 -0.419 . . . . 0.0 110.754 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.833 HG22 ' O ' ' B' ' 779' ' ' THR . 8.9 m -54.06 -38.26 37.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.572 -0.705 . . . . 0.0 109.908 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -61.22 -41.86 97.6 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.561 0.696 . . . . 0.0 110.425 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.14 -44.06 80.78 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.708 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.873 HD23 ' ND2' ' C' ' 750' ' ' ASN . 27.9 tp -82.88 -13.96 55.15 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.293 0.568 . . . . 0.0 111.351 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -52.99 -42.41 60.66 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -96.98 133.19 41.98 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 25.2 ttt180 . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.607 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.633 HD13 HD12 ' B' ' 663' ' ' LEU . 4.3 pp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.43 0.633 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.515 HD22 ' N ' ' C' ' 661' ' ' LEU . 3.3 mm? -113.13 152.6 29.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.344 0.592 . . . . 0.0 109.581 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -167.61 158.11 10.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.319 0.58 . . . . 0.0 109.719 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.663 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -53.18 -53.62 47.88 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 122.135 0.969 . . . . 0.0 109.62 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.581 ' N ' HD13 ' C' ' 663' ' ' LEU . 4.4 t70 -66.76 -18.53 65.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.062 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -81.12 -48.44 12.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.062 0.458 . . . . 0.0 110.495 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.451 ' CZ2' HD12 ' C' ' 661' ' ' LEU . 74.6 m95 -56.6 -46.42 80.88 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.28 0.562 . . . . 0.0 110.338 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.11 -25.67 67.11 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.325 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -35.64 81.54 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 122.077 -0.389 . . . . 0.0 111.463 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.5 -35.92 77.09 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.224 0.535 . . . . 0.0 111.424 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 58.9 m95 -59.91 -26.74 66.16 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.129 0.49 . . . . 0.0 110.826 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -74.09 -34.38 63.96 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.233 0.54 . . . . 0.0 110.975 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -53.83 -43.64 69.59 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.487 0.66 . . . . 0.0 110.552 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 55.89 41.34 30.12 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.404 0.621 . . . . 0.0 111.165 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -156.67 -72.63 0.1 Allowed 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.724 -0.61 . . . . 0.0 112.18 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.773 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.1 OUTLIER -68.19 -37.6 78.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-O 121.508 0.67 . . . . 0.0 111.684 -178.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.8 m -52.18 -33.65 41.59 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.987 -0.446 . . . . 0.0 112.163 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -56.97 -49.52 75.46 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.592 0.711 . . . . 0.0 110.205 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.678 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.22 -40.79 94.59 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.193 0.52 . . . . 0.0 109.788 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' C' ' 675' ' ' ILE . 13.7 mt -66.07 -38.25 87.82 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -96.02 -18.48 20.19 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.42 -16.06 31.77 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.644 -0.66 . . . . 0.0 111.809 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.678 HG23 ' O ' ' C' ' 678' ' ' TRP . 6.3 pt -62.93 -37.02 78.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.785 -0.572 . . . . 0.0 111.439 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 13.2 ttt-85 -53.79 -47.38 70.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.611 0.719 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.459 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -66.92 -36.52 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -59.74 -32.09 70.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.376 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 1.036 HG21 HD12 ' A' ' 686' ' ' ILE . 9.4 mm -61.16 -47.78 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.168 0.509 . . . . 0.0 109.856 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.4 mt -62.48 -39.86 85.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.206 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' C' ' 685' ' ' PHE . 96.5 mt -58.86 -36.83 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.404 HG23 ' O ' ' C' ' 685' ' ' PHE . 75.8 t -53.98 -40.05 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.8 -41.15 90.66 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.2 m -64.44 -37.8 88.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.656 0.741 . . . . 0.0 109.488 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -59.52 -43.54 93.38 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.262 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.422 ' HB ' HG12 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -68.12 -41.9 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 122.114 -0.366 . . . . 0.0 110.975 -177.514 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.72 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -26.65 65.15 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.626 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.5 tt -67.47 -40.33 85.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.882 0.849 . . . . 0.0 110.376 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -55.65 -28.98 58.39 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.72 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -59.31 -35.63 59.23 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.501 -0.75 . . . . 0.0 111.416 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.626 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.9 p -54.1 -29.82 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -55.9 -31.32 62.75 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.793 -0.567 . . . . 0.0 110.303 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.45 81.28 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.1 t -69.08 -41.89 81.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.91 -37.34 79.16 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.568 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 73.5 m -62.64 -39.31 93.44 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.989 0.423 . . . . 0.0 110.765 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -40.91 96.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.868 0.842 . . . . 0.0 108.857 178.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.467 HG22 HD21 ' C' ' 748' ' ' LEU . 98.1 t -62.04 -44.69 99.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -62.23 -35.64 79.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.593 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.419 ' HG2' ' CZ ' ' B' ' 707' ' ' ARG . 2.5 tmm_? -60.07 -50.92 71.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.907 0.86 . . . . 0.0 111.078 -177.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.492 HG21 ' HD2' ' A' ' 714' ' ' PRO . 1.2 t -77.72 -44.3 29.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.813 0.816 . . . . 0.0 111.167 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -72.97 -34.71 66.65 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.405 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.426 HE22 HD21 ' B' ' 755' ' ' LEU . 8.3 tt0 -102.82 -20.89 14.14 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 115.58 -177.27 17.07 Favored Glycine 0 N--CA 1.473 1.1 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -128.25 -50.96 1.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.471 ' HA ' HG21 ' B' ' 708' ' ' VAL . 31.6 p -106.78 159.48 29.74 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.356 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -34.06 94.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 122.424 2.082 . . . . 0.0 112.869 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.412 HD23 ' OD2' ' B' ' 758' ' ' ASP . 18.8 tp -81.03 -1.88 45.76 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.958 0.885 . . . . 0.0 113.315 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.797 0.808 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 tpt85 -59.03 -30.5 68.07 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.254 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -56.43 -13.38 2.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.669 ' HE ' HD12 ' B' ' 774' ' ' LEU . 16.8 mtm-85 -75.57 -44.84 41.12 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.565 -0.709 . . . . 0.0 111.468 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.35 -44.36 88.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.188 0.518 . . . . 0.0 109.991 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -36.04 71.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.041 0.448 . . . . 0.0 110.327 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -57.56 -42.86 83.87 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.908 -0.495 . . . . 0.0 110.274 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.546 HD12 ' O ' ' C' ' 742' ' ' ARG . 1.5 mp -53.96 -19.74 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.635 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . 0.711 ' HA ' HD22 ' B' ' 785' ' ' LEU . 65.5 mtt180 -59.44 -34.26 72.29 Favored 'General case' 0 C--N 1.343 0.285 0 O-C-N 121.071 -1.018 . . . . 0.0 109.26 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.545 ' O ' HD23 ' C' ' 748' ' ' LEU . 9.6 tt -57.35 -17.64 13.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . 0.583 HG12 ' ND2' ' C' ' 750' ' ' ASN . 0.3 OUTLIER -55.84 -53.35 38.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -179.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.873 ' ND2' HD23 ' B' ' 785' ' ' LEU . 4.7 m-80 -71.89 -18.68 62.03 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.558 0.694 . . . . 0.0 109.568 175.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.27 -20.58 36.8 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 111.737 -0.545 . . . . 0.0 111.737 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 40.9 p -58.31 -37.9 75.99 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -69.22 -50.34 48.22 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.653 0.74 . . . . 0.0 109.232 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.09 -34.64 72.22 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.935 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.465 ' C ' HD23 ' C' ' 755' ' ' LEU . 7.0 tt -58.71 -45.47 89.48 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.908 -0.495 . . . . 0.0 111.067 -177.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 74.2 mt -68.26 -41.78 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.771 0.796 . . . . 0.0 108.981 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -67.1 -30.68 70.77 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.74 -45.67 92.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.224 -0.923 . . . . 0.0 108.608 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.17 -42.27 72.69 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.595 0.712 . . . . 0.0 110.975 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -42.64 76.63 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . 0.442 ' O ' HD12 ' C' ' 765' ' ' LEU . 19.9 mtm180 -74.57 -49.44 21.78 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.062 0.458 . . . . 0.0 111.841 -178.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 26.6 t -59.77 -45.85 91.0 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.478 -0.764 . . . . 0.0 110.18 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.438 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.2 tt -68.84 -54.15 17.34 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.574 ' CB ' HD12 ' C' ' 771' ' ' LEU . 1.6 m -99.19 -49.63 4.42 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.826 0.822 . . . . 0.0 112.785 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . 0.442 HD12 ' O ' ' C' ' 761' ' ' ARG . 0.4 OUTLIER 77.41 -179.53 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.474 0.709 . . . . 0.0 109.368 -177.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.99 138.09 6.84 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.476 0.655 . . . . 0.0 111.156 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 m 57.94 165.07 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.5 0.667 . . . . 0.0 111.065 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.32 0.65 43.38 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.402 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -81.62 -44.76 16.76 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 -64.15 -28.36 69.71 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.561 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.574 HD12 ' CB ' ' C' ' 764' ' ' SER . 0.3 OUTLIER -58.18 -30.1 66.16 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.35 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -56.61 -32.88 65.72 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -65.27 -47.32 77.12 Favored 'General case' 0 C--N 1.352 0.693 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.561 HD13 HD12 ' C' ' 777' ' ' ILE . 4.5 mm? -59.2 -37.6 77.86 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.603 0.716 . . . . 0.0 110.319 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.55 ' O ' HG22 ' C' ' 778' ' ' VAL . 3.3 mp -57.68 -36.35 71.82 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.652 0.739 . . . . 0.0 109.909 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.89 -40.42 60.93 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.507 -0.746 . . . . 0.0 110.361 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.603 HG21 HH11 ' A' ' 742' ' ' ARG . 41.9 mt -62.88 -37.37 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 O-C-N 122.252 -0.28 . . . . 0.0 111.618 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.55 HG22 ' O ' ' C' ' 775' ' ' LEU . 29.6 m -55.44 -39.59 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.281 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . . . . . . . . . 4.7 m -63.47 -40.67 97.72 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-O 121.971 0.891 . . . . 0.0 109.584 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.81 -38.42 86.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.657 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.797 HG21 ' HB ' ' A' ' 746' ' ' ILE . 63.9 mt -60.56 -42.22 90.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.8 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.402 ' HA ' ' CG ' ' A' ' 747' ' ' ARG . 48.6 t -53.7 -38.33 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 120.018 -0.673 . . . . 0.0 109.631 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.34 -45.12 89.2 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.93 -0.481 . . . . 0.0 111.358 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.64 -45.1 65.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.752 HD23 ' HB3' ' A' ' 747' ' ' ARG . 11.8 tp -87.82 -13.98 40.76 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 121.011 -1.056 . . . . 0.0 110.599 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -51.89 -25.48 16.27 Favored Glycine 0 CA--C 1.538 1.485 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.7 136.31 52.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.859 -1.067 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.717 ' N ' HD23 ' C' ' 663' ' ' LEU . 3.5 tp . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 47.3 mt 58.13 104.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.772 0.796 . . . . 0.0 110.834 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -174.65 -171.51 0.57 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.568 HD12 ' N ' ' B' ' 660' ' ' LEU . 1.2 tt -52.69 -41.22 63.67 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.564 -0.71 . . . . 0.0 110.635 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -72.5 -32.24 66.02 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -77.48 -44.93 27.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.435 0.636 . . . . 0.0 110.867 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -70.46 -44.64 67.33 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.3 0.571 . . . . 0.0 110.847 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.79 65.82 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.524 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 46.3 t -66.92 -34.94 78.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.208 0.528 . . . . 0.0 111.271 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.98 -35.22 74.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.376 0.608 . . . . 0.0 111.079 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -59.88 -22.79 62.82 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.203 0.525 . . . . 0.0 111.242 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -79.86 -20.81 45.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.247 0.546 . . . . 0.0 111.264 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -71.55 -49.79 37.43 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.598 0.713 . . . . 0.0 110.456 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 39.3 t80 62.15 39.38 12.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.832 0.825 . . . . 0.0 111.118 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -152.77 -68.3 0.16 Allowed 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.83 -0.544 . . . . 0.0 110.94 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.07 -36.95 77.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.096 -0.377 . . . . 0.0 111.213 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.2 m -51.81 -34.35 39.71 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -64.84 -50.1 67.99 Favored 'General case' 0 C--N 1.343 0.284 0 O-C-N 121.685 -0.634 . . . . 0.0 110.32 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.606 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.4 t90 -65.69 -44.01 87.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.79 0.805 . . . . 0.0 109.695 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -35.72 81.33 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -96.13 -43.72 7.62 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -68.21 -6.66 24.72 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.693 -0.629 . . . . 0.0 112.552 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.764 HD12 ' N ' ' A' ' 683' ' ' ARG . 1.7 pp -60.63 -36.43 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 121.626 -0.671 . . . . 0.0 110.403 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.764 ' N ' HD12 ' A' ' 682' ' ' ILE . 9.9 ttt-85 -57.06 -47.27 81.38 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.046 0.45 . . . . 0.0 110.606 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.436 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -67.74 -34.13 65.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.4 OUTLIER -59.9 -31.33 69.72 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.041 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.872 HG21 HD12 ' B' ' 686' ' ' ILE . 14.5 mm -60.7 -49.31 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.117 0.484 . . . . 0.0 109.824 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.79 -40.39 84.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.99 -36.77 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.86 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 685' ' ' PHE . 86.9 t -54.16 -39.83 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.4 -37.09 91.5 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.4 m -64.87 -38.29 90.48 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.759 0.79 . . . . 0.0 109.602 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.751 HD11 ' HG3' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -67.1 -40.8 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.339 -179.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.81 -23.41 61.15 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.552 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -61.63 -38.28 87.09 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.03 0.919 . . . . 0.0 109.506 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 1.5 mmt180 -55.92 -28.0 54.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.286 1.034 . . . . 0.0 112.767 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 mm -58.7 -37.44 65.82 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 O-C-N 121.077 -1.014 . . . . 0.0 108.339 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.771 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.5 p -67.72 -30.74 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 O-C-N 121.481 -0.762 . . . . 0.0 109.887 176.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.5 m-85 -55.88 -28.68 57.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 110.442 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.04 71.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.8 m -64.49 -36.0 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 O-C-N 121.669 -0.644 . . . . 0.0 110.043 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.2 tp -57.7 -40.05 78.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 122.028 -0.42 . . . . 0.0 111.016 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . 0.548 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 1.6 m -62.78 -37.41 86.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.534 0.683 . . . . 0.0 110.499 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -42.0 96.7 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 122.089 0.947 . . . . 0.0 108.702 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 748' ' ' LEU . 73.4 t -65.18 -43.74 95.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.981 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 710' ' ' GLN . 1.6 m-80 -62.22 -42.89 99.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.356 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.54 HH21 HG23 ' A' ' 708' ' ' VAL . 7.6 tmm_? -60.99 -43.79 98.36 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.411 0.624 . . . . 0.0 110.697 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.54 HG23 HH21 ' A' ' 707' ' ' ARG . 0.9 OUTLIER -74.4 -43.47 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.178 0.989 . . . . 0.0 109.179 178.795 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -73.13 -15.04 61.49 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 706' ' ' ASN . 0.5 OUTLIER -101.23 -22.3 14.68 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.62 1.554 . . . . 0.0 113.268 -177.552 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . 0.587 ' HA3' HD22 ' A' ' 715' ' ' LEU . . . 130.98 14.07 1.89 Allowed Glycine 0 CA--C 1.537 1.422 0 O-C-N 121.376 -0.828 . . . . 0.0 113.544 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.468 ' HB3' ' H ' ' A' ' 713' ' ' SER . 0.1 OUTLIER 61.33 -127.62 0.83 Allowed 'General case' 0 CA--C 1.571 1.775 0 O-C-N 121.556 -0.967 . . . . 0.0 110.466 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.468 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 89.3 p -62.08 159.9 34.41 Favored Pre-proline 0 C--N 1.353 0.72 0 O-C-N 120.669 -1.27 . . . . 0.0 110.782 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -35.12 110.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 122.301 2.0 . . . . 0.0 112.593 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.639 HD23 ' OD2' ' C' ' 758' ' ' ASP . 0.0 OUTLIER -109.04 -20.73 12.92 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 122.56 1.172 . . . . 0.0 111.798 -179.622 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 121.683 0.754 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -58.02 -26.47 62.46 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.595 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -9.23 0.42 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 8.1 mtm-85 -62.89 -46.53 87.38 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.369 -0.832 . . . . 0.0 111.142 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.543 ' O ' HG23 ' C' ' 781' ' ' ILE . 44.4 p-10 -65.84 -38.68 89.51 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.283 0.563 . . . . 0.0 111.871 -178.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -71.44 -38.01 71.39 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 121.163 -0.96 . . . . 0.0 109.845 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 20.6 p -66.25 -45.96 78.77 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.948 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.83 ' HB ' HG21 ' C' ' 781' ' ' ILE . 1.4 mp -63.12 -46.74 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-O 117.89 -1.053 . . . . 0.0 111.262 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.653 ' HE ' HD23 ' C' ' 785' ' ' LEU 0.321 0.1 OUTLIER -69.93 -0.06 6.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 115.822 -2.351 . . . . 0.0 111.614 -177.624 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.795 ' O ' HD13 ' A' ' 748' ' ' LEU . 2.8 tm? -57.23 -15.65 6.41 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 169.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.515 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.314 2.0 t -53.4 -54.64 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 175.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.56 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.3 m-80 -73.25 -27.21 61.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.48 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.478 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.8 -19.3 28.35 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.697 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 52.2 p -57.27 -37.23 72.07 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.91 -49.45 76.15 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.29 72.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.646 178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.15 -43.24 92.04 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.706 -0.621 . . . . 0.0 111.899 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . 0.424 HG22 HD12 ' A' ' 760' ' ' LEU . 49.2 mt -61.36 -33.66 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -69.43 -30.63 68.6 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.947 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 5.7 m-20 -56.07 -48.44 76.07 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.985 0.898 . . . . 0.0 108.955 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.39 -44.3 68.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.509 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.424 HD12 HG22 ' A' ' 756' ' ' ILE . 30.1 mt -67.37 -35.0 78.46 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -177.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 32.4 mtm180 -79.73 -19.51 48.63 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 68.6 p -77.36 -46.39 22.99 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.34 -0.85 . . . . 0.0 111.27 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 774' ' ' LEU . 2.8 mp -68.89 -53.97 18.16 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 53.8 p -98.45 -48.95 4.83 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.221 -0.924 . . . . 0.0 111.939 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.8 tp 89.22 -82.97 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.675 1.19 . . . . 0.0 110.263 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -106.05 -65.42 1.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.572 -0.705 . . . . 0.0 110.756 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.6 m -103.05 144.44 31.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.117 0.484 . . . . 0.0 110.596 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -62.41 -26.74 68.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.085 0.469 . . . . 0.0 110.373 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -52.98 -39.06 62.73 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.599 0.714 . . . . 0.0 109.885 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 6.4 tpt85 -63.35 -30.62 71.72 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.662 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.42 -38.24 83.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.165 0.507 . . . . 0.0 110.481 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 58.0 ttp180 -59.03 -42.16 89.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.648 0.737 . . . . 0.0 109.207 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -69.05 -43.42 74.68 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.821 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -62.16 -37.7 86.19 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 121.53 0.681 . . . . 0.0 111.46 -179.317 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.39 -36.92 83.83 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 121.65 -0.656 . . . . 0.0 111.062 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 56.4 mt -74.15 -44.43 53.63 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 774' ' ' LEU . 2.3 pp -59.96 -37.14 71.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 121.98 -0.45 . . . . 0.0 111.419 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.753 ' O ' HG22 ' A' ' 781' ' ' ILE . 26.7 m -65.92 -43.17 93.0 Favored 'Isoleucine or valine' 0 C--N 1.346 0.42 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.757 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.708 ' O ' HG22 ' A' ' 782' ' ' VAL . 47.2 p -63.81 -46.6 84.39 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.433 -0.792 . . . . 0.0 111.508 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.11 -30.32 71.5 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.774 HG21 ' CG2' ' B' ' 746' ' ' ILE . 0.2 OUTLIER -53.35 -35.24 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 O-C-N 121.847 -0.533 . . . . 0.0 110.563 -178.01 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 779' ' ' THR . 17.1 m -53.76 -38.33 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -62.69 -43.22 99.37 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.761 0.791 . . . . 0.0 110.216 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 22.5 tp -68.03 -40.98 82.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.359 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 1.1 tp -86.03 -11.07 53.85 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.988 0.423 . . . . 0.0 111.826 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -72.25 1.41 34.39 Favored Glycine 0 CA--C 1.54 1.65 0 O-C-N 121.75 -0.593 . . . . 0.0 112.488 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -116.12 151.94 34.63 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.732 -0.863 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 54.7 ttp85 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.524 179.753 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.589 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.2 mm? 61.91 112.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.227 0.536 . . . . 0.0 109.865 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 170.99 -176.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.669 HD13 HD22 ' C' ' 660' ' ' LEU . 5.7 tp -54.33 -48.42 71.39 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 122.171 0.986 . . . . 0.0 109.663 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -65.4 -32.44 74.07 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.541 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -78.73 -44.18 24.07 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.151 0.5 . . . . 0.0 110.726 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.73 -44.08 62.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.299 0.571 . . . . 0.0 111.319 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.57 -30.28 71.2 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.999 0.428 . . . . 0.0 111.534 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 24.5 p -63.35 -25.79 68.46 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.068 0.461 . . . . 0.0 111.699 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.05 -38.67 86.99 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.304 0.574 . . . . 0.0 110.963 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -61.71 -12.98 19.05 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.978 0.418 . . . . 0.0 111.537 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.64 -32.28 20.65 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.241 0.543 . . . . 0.0 111.252 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.57 -52.19 64.4 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.48 0.657 . . . . 0.0 110.507 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 33.1 t80 58.19 27.76 15.56 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.409 0.623 . . . . 0.0 112.184 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -141.07 -71.17 0.36 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.436 0.636 . . . . 0.0 110.455 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.69 HD11 HD23 ' B' ' 679' ' ' LEU . 0.1 OUTLIER -68.18 -36.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 23.4 m -51.28 -33.49 28.86 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.039 -0.413 . . . . 0.0 111.539 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.94 -50.31 73.01 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.704 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.4 t90 -66.16 -41.86 89.77 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.933 0.873 . . . . 0.0 109.422 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.69 HD23 HD11 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -58.07 -35.52 71.49 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -177.723 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -109.46 -31.19 7.61 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -68.22 -6.76 25.34 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.451 -0.781 . . . . 0.0 112.91 -177.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.704 HG23 ' O ' ' B' ' 678' ' ' TRP . 0.2 OUTLIER -60.41 -36.29 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.6 -0.688 . . . . 0.0 110.839 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -53.32 -47.6 69.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.615 0.245 . . . . 0.0 111.028 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.488 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.4 mp -71.54 -35.64 57.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' B' ' 682' ' ' ILE . 0.2 OUTLIER -59.7 -31.07 69.25 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.064 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.872 HD12 HG21 ' A' ' 686' ' ' ILE . 15.0 mm -60.89 -47.28 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 121.774 -0.579 . . . . 0.0 109.918 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.71 -41.67 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.72 -37.94 73.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -60.18 -40.15 82.69 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . 0.545 ' O ' HG23 ' B' ' 693' ' ' ILE . . . -61.41 -27.1 67.24 Favored Glycine 0 CA--C 1.541 1.716 0 N-CA-C 111.742 -0.543 . . . . 0.0 111.742 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 19.9 m -60.78 -45.38 94.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.607 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -33.13 71.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -176.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.859 HD11 ' HE ' ' C' ' 696' ' ' ARG . 0.1 OUTLIER -57.86 -43.93 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.932 0.787 . . . . 0.0 109.739 -178.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.05 -32.68 83.11 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.55 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.8 tt -60.46 -37.48 81.12 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 122.067 0.937 . . . . 0.0 110.769 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.751 ' HG3' HD11 ' A' ' 693' ' ' ILE . 27.9 mmt180 -55.87 -28.49 56.8 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 -178.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.754 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.59 -36.39 59.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 O-C-N 120.978 -1.076 . . . . 0.0 110.419 -176.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -56.82 -30.22 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 121.253 -0.905 . . . . 0.0 110.561 178.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -56.53 -30.92 63.61 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.711 -0.618 . . . . 0.0 110.317 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.1 -37.69 77.75 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -41.82 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.48 -37.74 73.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.077 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.7 m -62.86 -35.46 80.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 110.537 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.77 -43.21 97.07 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 122.406 1.098 . . . . 0.0 108.997 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.521 HG13 HD11 ' B' ' 748' ' ' LEU . 94.7 t -69.39 -45.49 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.201 1.001 . . . . 0.0 109.354 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.475 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.5 m-80 -62.82 -35.58 80.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.199 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 16.1 ttm-85 -66.41 -50.25 64.06 Favored 'General case' 0 N--CA 1.44 -0.934 0 O-C-N 121.301 -0.874 . . . . 0.0 110.688 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.9 OUTLIER -78.72 -45.07 25.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -179.143 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -61.38 -45.23 95.24 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.4 pt20 -104.54 -22.89 13.2 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 138.66 167.64 11.03 Favored Glycine 0 CA--C 1.534 1.231 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.82 -83.6 0.55 Allowed 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.795 -0.827 . . . . 0.0 112.65 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 2.8 m -62.87 159.44 45.47 Favored Pre-proline 0 N--CA 1.463 0.184 0 O-C-N 121.331 -0.855 . . . . 0.0 110.177 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.582 ' HG3' HD23 ' A' ' 748' ' ' LEU . 11.6 Cg_exo -30.08 108.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.529 2.153 . . . . 0.0 113.372 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.44 ' O ' ' C ' ' B' ' 716' ' ' SER . 4.8 tt -70.92 -20.38 62.49 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -176.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.44 ' C ' ' O ' ' B' ' 715' ' ' LEU . 12.4 t . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 122.402 1.096 . . . . 0.0 112.91 -178.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 11.9 mp0 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 11.4 mtp85 -72.24 -28.51 63.2 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.202 0.525 . . . . 0.0 110.975 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.9 -5.19 1.92 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.494 ' NE ' HD11 ' A' ' 774' ' ' LEU . 0.1 OUTLIER -54.87 -32.71 61.1 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.701 -1.249 . . . . 0.0 109.423 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -58.59 -34.61 71.29 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 122.08 0.943 . . . . 0.0 108.553 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . 0.48 ' HG2' HH21 ' B' ' 744' ' ' ARG . 0.0 OUTLIER -63.54 -46.96 83.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 122.141 0.972 . . . . 0.0 109.135 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 13.8 t -62.34 -47.18 85.37 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.783 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.774 ' CG2' HG21 ' A' ' 781' ' ' ILE . 1.4 mp -52.63 -21.4 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 O-C-N 121.24 -0.912 . . . . 0.0 109.655 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -43.54 98.64 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.669 -0.645 . . . . 0.0 110.542 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.521 HD11 HG13 ' B' ' 705' ' ' VAL . 0.9 OUTLIER -55.59 -15.37 2.84 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.668 -0.645 . . . . 0.0 111.964 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.44 -53.76 32.57 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.433 ' H ' HD22 ' B' ' 750' ' ' ASN . 4.0 m-80 -72.59 -17.77 61.66 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.125 174.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.0 -20.06 32.74 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.857 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 3.5 m -58.47 -38.45 77.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 118.356 1.078 . . . . 0.0 109.572 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 20.4 tp -70.33 -48.04 58.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.65 0.738 . . . . 0.0 109.731 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.56 81.38 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -45.24 92.87 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.649 -0.657 . . . . 0.0 110.627 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . 0.439 HG22 HD12 ' B' ' 760' ' ' LEU . 47.2 mt -62.01 -36.4 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.11 -30.96 69.34 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.952 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.512 ' OD2' HD23 ' C' ' 715' ' ' LEU . 6.9 m-20 -55.94 -48.32 75.96 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.56 -45.32 65.67 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.034 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . 0.439 HD12 HG22 ' B' ' 756' ' ' ILE . 19.9 mt -66.91 -31.79 72.61 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -79.98 -49.47 11.79 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 1.2 m -65.24 -45.23 85.48 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.543 -0.723 . . . . 0.0 111.576 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.586 ' HG ' HD22 ' B' ' 774' ' ' LEU . 1.9 tp -64.66 -53.25 50.48 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.838 -0.539 . . . . 0.0 112.447 -178.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . 0.411 ' OG ' HD12 ' B' ' 771' ' ' LEU . 3.0 m -97.5 -47.57 5.61 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 1.8 mt 71.63 107.55 0.06 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.8 0.81 . . . . 0.0 110.315 -178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.89 -78.45 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.881 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -110.11 175.47 5.42 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.612 0.72 . . . . 0.0 111.572 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -84.22 -27.96 27.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.064 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.61 -40.14 82.43 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 122.109 0.957 . . . . 0.0 109.149 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.62 -29.26 67.88 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.892 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.411 HD12 ' OG ' ' B' ' 764' ' ' SER . 8.4 tt -59.16 -32.33 69.79 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.679 -0.638 . . . . 0.0 109.986 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -56.78 -32.51 65.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.03 -41.26 99.47 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.586 HD22 ' HG ' ' B' ' 763' ' ' LEU . 2.7 tp -58.86 -38.49 78.9 Favored 'General case' 0 C--N 1.349 0.548 0 CA-C-O 121.388 0.613 . . . . 0.0 110.835 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.34 -37.04 74.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.275 0.56 . . . . 0.0 109.997 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.42 -34.85 68.14 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.056 0.455 . . . . 0.0 110.592 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.3 -39.26 84.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.089 0.471 . . . . 0.0 109.779 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.76 ' O ' HG22 ' B' ' 781' ' ' ILE . 58.6 t -66.28 -46.63 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.784 -0.572 . . . . 0.0 109.945 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.645 ' O ' HG22 ' B' ' 782' ' ' VAL . 0.2 OUTLIER -64.21 -44.48 91.82 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 122.079 -0.388 . . . . 0.0 112.023 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -31.5 72.04 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 122.052 -0.405 . . . . 0.0 111.739 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.76 HG22 ' O ' ' B' ' 778' ' ' VAL . 0.4 OUTLIER -60.01 -36.6 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 O-C-N 121.727 -0.608 . . . . 0.0 112.07 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.645 HG22 ' O ' ' B' ' 779' ' ' THR . 5.4 m -59.22 -41.78 84.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 121.655 -0.653 . . . . 0.0 112.083 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -41.85 91.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.273 0.559 . . . . 0.0 111.338 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.68 -44.04 67.84 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.659 HD23 ' CG ' ' C' ' 750' ' ' ASN . 18.9 tp -83.78 -22.87 31.72 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.027 0.441 . . . . 0.0 111.73 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.67 -33.21 62.49 Favored Glycine 0 CA--C 1.533 1.217 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -83.19 146.99 28.3 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.398 0.618 . . . . 0.0 110.581 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 118.075 -0.964 . . . . 0.0 110.476 179.691 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.669 HD22 HD13 ' B' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 CA-C-O 120.641 0.258 . . . . 0.0 110.784 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 25.7 mt 59.62 110.74 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.519 0.676 . . . . 0.0 110.852 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -167.6 171.1 10.55 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 121.244 0.545 . . . . 0.0 109.711 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.6 OUTLIER -56.91 -50.48 72.41 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.62 0.724 . . . . 0.0 110.054 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.541 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -75.18 -16.86 60.48 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.908 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -80.96 -49.01 11.5 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.022 0.439 . . . . 0.0 110.881 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -62.71 -46.14 89.52 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.248 0.547 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.23 -23.54 67.47 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -30.55 68.24 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 122.003 -0.436 . . . . 0.0 111.781 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.0 -39.67 94.63 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -59.47 -13.51 9.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.762 -0.586 . . . . 0.0 111.848 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -81.77 -21.11 37.99 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.277 0.561 . . . . 0.0 110.899 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -62.44 -42.22 99.3 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.648 0.737 . . . . 0.0 110.138 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 61.37 24.76 14.82 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -154.09 -72.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.562 -0.711 . . . . 0.0 112.313 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -37.1 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-O 121.52 0.676 . . . . 0.0 110.257 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.8 m -52.2 -33.7 42.16 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.778 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -56.52 -48.88 76.31 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 121.63 0.729 . . . . 0.0 109.341 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.524 ' O ' HG23 ' C' ' 682' ' ' ILE . 3.8 t90 -58.86 -38.09 77.97 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.874 -0.516 . . . . 0.0 109.8 178.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 9.4 mt -60.72 -41.08 94.6 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -103.27 -39.22 6.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -68.87 -18.56 64.15 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.759 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.3 pp -60.45 -36.57 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.449 -0.782 . . . . 0.0 109.947 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.759 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -53.7 -46.98 70.91 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.02 -35.23 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.97 -36.77 77.83 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.994 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.811 HG21 HD12 ' A' ' 686' ' ' ILE . 18.5 mm -60.78 -45.53 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.89 -38.43 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.91 -37.99 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.5 -40.01 72.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.29 -37.54 73.87 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.0 m -67.37 -38.64 85.08 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.452 1.12 . . . . 0.0 109.661 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.415 HD23 HG12 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.6 -46.12 89.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.406 -177.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.415 HD12 ' N ' ' C' ' 694' ' ' GLY . 1.7 pp -60.29 -43.63 93.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 O-C-N 122.017 -0.427 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.54 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.74 -30.68 73.17 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.61 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.6 tt -53.77 -37.22 63.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.058 0.932 . . . . 0.0 110.139 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.859 ' HE ' HD11 ' B' ' 693' ' ' ILE . 23.0 mmt180 -55.69 -27.85 52.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.54 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.7 tt -57.66 -35.41 50.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.079 -1.013 . . . . 0.0 110.831 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.61 HG12 ' O ' ' C' ' 695' ' ' LEU . 14.5 p -54.08 -29.86 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.223 -0.923 . . . . 0.0 109.527 177.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -56.83 -31.69 65.0 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.263 -0.898 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . 0.548 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.14 -45.3 93.51 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 45.3 t -65.82 -35.86 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.009 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -64.95 -44.89 87.95 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.231 0.539 . . . . 0.0 110.865 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 36.3 p -64.13 -33.04 74.88 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.15 0.5 . . . . 0.0 110.776 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.75 95.23 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.833 0.825 . . . . 0.0 108.922 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.535 ' HA ' HD13 ' C' ' 748' ' ' LEU . 0.9 OUTLIER -67.62 -45.81 84.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-O 122.149 0.976 . . . . 0.0 108.618 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.06 -36.48 83.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.224 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -49.21 73.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.208 0.528 . . . . 0.0 111.26 -177.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.556 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -76.73 -42.98 34.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.501 0.667 . . . . 0.0 111.511 -178.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -70.38 -41.35 73.18 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.407 ' O ' HD22 ' C' ' 715' ' ' LEU . 3.0 mt-30 -102.23 -22.13 14.23 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.759 0.79 . . . . 0.0 112.973 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.35 160.37 24.21 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -112.98 -47.63 3.03 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.936 -0.743 . . . . 0.0 111.536 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.452 ' HA ' HG21 ' B' ' 708' ' ' VAL . 79.5 p -69.11 144.28 95.14 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 118.616 -0.707 . . . . 0.0 110.306 -179.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -35.23 97.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.553 0 C-N-CA 122.261 1.974 . . . . 0.0 112.394 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.512 HD23 ' OD2' ' B' ' 758' ' ' ASP . 13.6 tp -75.19 5.1 5.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.82 0.819 . . . . 0.0 112.277 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 122.422 1.106 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -61.1 -26.55 67.74 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.61 -1.177 . . . . 0.0 112.084 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.7 -11.59 1.0 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -68.42 -40.89 81.03 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.53 -0.731 . . . . 0.0 111.46 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.33 -36.02 72.78 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 122.031 -0.418 . . . . 0.0 110.501 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -71.34 -46.73 59.84 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.337 0.589 . . . . 0.0 110.017 178.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 3.1 p -59.93 -38.51 82.62 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.469 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.548 ' CG2' HG21 ' B' ' 781' ' ' ILE . 1.0 OUTLIER -57.44 -19.67 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -59.55 -28.11 66.81 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.556 HD11 HG12 ' C' ' 708' ' ' VAL . 15.7 mt -55.65 -20.39 13.8 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.915 178.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . 0.496 HG23 ' O ' ' C' ' 746' ' ' ILE . 70.7 t -56.0 -54.89 21.82 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.659 ' CG ' HD23 ' B' ' 785' ' ' LEU . 3.1 m-80 -73.29 -21.9 60.48 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.784 174.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.15 33.32 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.206 -178.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 37.5 m -58.59 -37.73 76.44 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 117.921 0.861 . . . . 0.0 109.315 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 15.2 tp -69.45 -50.44 45.55 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.496 0.665 . . . . 0.0 109.743 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.2 -35.36 80.06 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.521 HD13 ' C ' ' C' ' 755' ' ' LEU . 2.7 tm? -59.82 -45.34 92.67 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.182 0.515 . . . . 0.0 111.158 -178.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 64.4 mt -67.77 -41.77 85.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.86 0.838 . . . . 0.0 109.338 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.14 -30.09 68.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.207 -179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . 0.639 ' OD2' HD23 ' A' ' 715' ' ' LEU . 81.4 m-20 -55.32 -48.87 73.5 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.495 -0.753 . . . . 0.0 109.987 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -70.58 -44.72 66.76 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.876 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 62.3 mt -68.88 -36.08 77.66 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 26.2 mtm180 -72.39 -50.02 29.63 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.965 -0.459 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 2.5 t -64.87 -44.45 89.65 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 122.159 0.981 . . . . 0.0 110.337 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.482 ' C ' HD23 ' C' ' 763' ' ' LEU . 8.1 tt -67.94 -53.17 28.36 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.212 -0.903 . . . . 0.0 113.225 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.437 ' OG ' HD12 ' C' ' 771' ' ' LEU . 1.3 m -96.78 -37.47 10.26 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 56.5 mt 62.06 116.09 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.466 0.651 . . . . 0.0 110.128 -178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 2.0 t80 59.29 -162.96 0.23 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.874 -0.516 . . . . 0.0 109.997 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 1.6 p -83.38 91.89 7.43 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.667 0.746 . . . . 0.0 111.671 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 42.42 -165.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.888 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 10.9 t60 75.91 -61.42 0.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -61.31 -30.06 70.26 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.702 176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.437 HD12 ' OG ' ' C' ' 764' ' ' SER . 8.0 tt -60.04 -30.8 69.43 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 122.075 -0.391 . . . . 0.0 109.957 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -56.69 -35.15 68.15 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . 0.401 ' O ' HG13 ' C' ' 777' ' ' ILE . 3.7 m-20 -67.12 -37.06 83.23 Favored 'General case' 0 C--N 1.341 0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.684 HD13 ' O ' ' C' ' 774' ' ' LEU . 1.8 tm? -58.06 -38.49 76.41 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.064 0.459 . . . . 0.0 110.21 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.467 ' O ' HG22 ' C' ' 778' ' ' VAL . 9.8 mp -58.98 -37.59 77.16 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 51.1 mt -75.09 -39.99 60.33 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 121.675 -0.641 . . . . 0.0 111.339 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.474 HG22 HG13 ' C' ' 781' ' ' ILE . 29.1 mt -62.49 -37.49 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.563 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.467 HG22 ' O ' ' C' ' 775' ' ' LEU . 7.8 m -55.16 -39.83 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 119.202 0.91 . . . . 0.0 110.015 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.445 ' O ' HG22 ' C' ' 782' ' ' VAL . 5.8 m -63.41 -39.8 95.47 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 121.871 0.843 . . . . 0.0 109.741 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.43 -37.55 83.2 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.536 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.83 HG21 ' HB ' ' A' ' 746' ' ' ILE . 89.4 mt -61.69 -47.69 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.41 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.446 ' HA ' ' HD2' ' A' ' 747' ' ' ARG . 20.7 m -54.13 -37.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 119.23 -0.988 . . . . 0.0 110.677 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -61.75 -41.28 97.48 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.318 0.58 . . . . 0.0 111.694 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.76 -44.69 76.9 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.653 HD23 ' HE ' ' A' ' 747' ' ' ARG . 0.5 OUTLIER -80.01 -27.45 39.57 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.093 -1.004 . . . . 0.0 110.713 -178.185 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . 0.418 ' HA2' ' CZ ' ' A' ' 747' ' ' ARG . . . -52.29 -33.8 39.63 Favored Glycine 0 CA--C 1.534 1.223 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.13 143.67 50.81 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 122.186 -0.597 . . . . 0.0 110.178 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.544 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 121.669 0.747 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 mt 61.92 134.69 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.996 0.903 . . . . 0.0 111.82 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 174.81 163.59 0.23 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.495 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.416 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.8 OUTLIER -46.36 -41.48 13.52 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.64 0.733 . . . . 0.0 110.148 178.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -33.87 76.97 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.774 -179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -74.8 -44.77 47.7 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.417 0.627 . . . . 0.0 109.782 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -63.12 -46.39 87.53 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 121.436 0.636 . . . . 0.0 110.364 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.19 61.82 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.493 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 2.7 m -65.38 -33.25 75.52 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.517 0.675 . . . . 0.0 110.408 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.604 HD23 HG23 ' A' ' 676' ' ' THR . 19.6 tp -65.35 -23.75 67.07 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.808 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -60.02 -29.47 68.52 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.933 -0.48 . . . . 0.0 111.586 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.8 -14.48 62.78 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 19.4 m95 -68.44 -49.63 58.5 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.439 0.638 . . . . 0.0 110.108 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 13.3 t80 65.83 2.77 2.28 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -126.04 -66.78 0.91 Allowed 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.279 -0.888 . . . . 0.0 111.942 -179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -67.42 -36.92 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 121.368 0.604 . . . . 0.0 111.025 -179.049 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.604 HG23 HD23 ' A' ' 669' ' ' LEU . 2.9 m -52.07 -33.38 38.96 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.471 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -56.4 -49.57 74.1 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.507 0.67 . . . . 0.0 109.777 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.77 ' O ' HG23 ' A' ' 682' ' ' ILE . 1.8 t90 -65.36 -43.9 89.34 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 121.084 0.469 . . . . 0.0 109.809 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.485 HD12 HD21 ' A' ' 669' ' ' LEU . 2.6 mt -61.92 -34.85 76.83 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.9 t90 -103.52 -15.03 15.97 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -94.5 -9.19 36.15 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.77 HG23 ' O ' ' A' ' 678' ' ' TRP . 0.2 OUTLIER -62.38 -35.95 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 O-C-N 121.371 -0.831 . . . . 0.0 110.818 179.054 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -47.42 68.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.783 0.325 . . . . 0.0 111.266 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 684' ' ' ILE . 2.5 mp -70.9 -35.34 59.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.496 ' HB2' ' HA ' ' A' ' 682' ' ' ILE . 0.2 OUTLIER -60.61 -29.0 68.94 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.584 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.868 HD12 HG21 ' C' ' 686' ' ' ILE . 15.9 mm -60.52 -51.06 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.739 -0.601 . . . . 0.0 110.123 -179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.62 -41.03 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.93 -37.49 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.31 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 685' ' ' PHE . 61.6 t -54.86 -43.29 67.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -52.68 -40.08 55.44 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 5.9 m -65.49 -38.67 90.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.848 0.832 . . . . 0.0 109.615 177.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.73 -43.05 94.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.304 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.512 HD11 HH11 ' B' ' 696' ' ' ARG . 0.8 OUTLIER -65.36 -42.7 94.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-O 121.126 0.489 . . . . 0.0 109.951 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.85 -24.92 65.17 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 178.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.473 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.9 OUTLIER -55.92 -38.61 70.51 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.021 0.915 . . . . 0.0 109.185 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 5.0 mmt180 -55.72 -28.15 54.26 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.827 0.851 . . . . 0.0 111.775 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.99 -39.09 77.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.801 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.74 -30.76 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.662 -0.649 . . . . 0.0 109.963 176.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 1.9 m-85 -55.76 -29.34 59.45 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 122.003 -0.436 . . . . 0.0 110.692 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.56 -37.24 72.79 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.9 m -60.71 -35.98 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 O-C-N 121.701 -0.624 . . . . 0.0 109.503 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.92 -44.62 91.35 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.81 -0.556 . . . . 0.0 109.88 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -34.66 77.78 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 122.117 0.96 . . . . 0.0 108.819 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.573 HD13 HH22 ' A' ' 707' ' ' ARG . 0.1 OUTLIER -60.63 -44.29 96.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 122.308 1.052 . . . . 0.0 108.272 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.669 HG22 HD12 ' A' ' 748' ' ' LEU . 54.2 t -66.81 -41.81 88.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.889 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -62.34 -36.91 83.68 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.036 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.573 HH22 HD13 ' A' ' 704' ' ' LEU . 36.0 ttm105 -57.65 -49.49 76.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 120.833 -1.167 . . . . 0.0 110.481 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.412 HG21 ' HD2' ' B' ' 714' ' ' PRO . 1.0 OUTLIER -76.97 -45.21 31.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.147 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -74.71 -18.33 60.53 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -177.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.4 HE22 HD21 ' C' ' 755' ' ' LEU . 4.5 tt0 -101.26 -21.01 15.01 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -175.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 120.15 13.64 5.83 Favored Glycine 0 CA--C 1.542 1.78 0 O-C-N 121.604 -0.685 . . . . 0.0 113.115 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 59.29 -83.77 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 O-C-N 121.934 -0.745 . . . . 0.0 112.069 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 92.2 p -102.77 159.99 27.62 Favored Pre-proline 0 C--N 1.347 0.462 0 O-C-N 121.2 -0.938 . . . . 0.0 109.721 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -41.75 106.57 0.07 OUTLIER 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.386 1.391 . . . . 0.0 111.104 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.555 HD23 ' N ' ' A' ' 716' ' ' SER . 0.0 OUTLIER -104.82 -20.64 13.53 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -175.733 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.555 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.1 t . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 121.498 0.666 . . . . 0.0 111.723 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 . . . . . 0 C--O 1.237 0.395 0 CA-C-O 121.714 0.768 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -57.91 -26.29 62.0 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.305 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -15.65 2.87 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.915 -0.49 . . . . 0.0 111.394 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.595 ' CZ ' HD21 ' C' ' 774' ' ' LEU . 21.0 ttp180 -62.61 -46.12 89.73 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.858 -0.526 . . . . 0.0 109.898 179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -59.15 -33.89 71.44 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.849 0.833 . . . . 0.0 109.043 178.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -44.54 66.7 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.721 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 8.4 p -58.44 -44.46 89.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.835 -0.541 . . . . 0.0 110.204 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.792 ' O ' HG22 ' A' ' 749' ' ' VAL . 1.9 mp -56.52 -20.9 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.245 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.724 ' HA ' HD22 ' C' ' 785' ' ' LEU . 67.6 mtp85 -59.14 -24.29 62.9 Favored 'General case' 0 C--N 1.345 0.378 0 O-C-N 121.468 -0.77 . . . . 0.0 110.178 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.786 ' O ' HD13 ' A' ' 748' ' ' LEU . 3.1 tm? -70.59 -17.87 62.9 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.984 -0.448 . . . . 0.0 111.576 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.792 HG22 ' O ' ' A' ' 746' ' ' ILE . 29.9 m -55.76 -54.91 21.06 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 O-C-N 120.793 -1.192 . . . . 0.0 110.78 -178.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.846 HD22 HD23 ' C' ' 785' ' ' LEU . 1.2 m-80 -72.75 -21.42 61.02 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 173.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.68 30.82 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.699 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 3.3 p -57.92 -37.79 74.73 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.808 0.804 . . . . 0.0 109.261 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 37.9 tp -65.38 -49.48 69.15 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -61.98 -34.58 76.41 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.703 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.415 ' C ' HD23 ' A' ' 755' ' ' LEU . 7.0 tt -58.77 -44.85 90.74 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 122.013 -0.43 . . . . 0.0 111.477 -177.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 6.7 mm -63.04 -33.33 60.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 177.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.29 -30.02 68.01 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.494 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 710' ' ' GLN . 30.5 m-20 -54.97 -47.13 74.97 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.699 -0.626 . . . . 0.0 109.672 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.58 -45.2 65.83 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.733 0.778 . . . . 0.0 111.043 178.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.458 ' HA ' HD11 ' A' ' 763' ' ' LEU . 24.2 mt -62.54 -29.58 70.67 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 44.7 mtt85 -81.07 -23.28 38.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -176.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 9.9 t -75.75 -46.83 28.71 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.88 -1.137 . . . . 0.0 111.955 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.531 ' HA ' HD22 ' A' ' 774' ' ' LEU . 0.0 OUTLIER -69.66 -54.37 14.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . 0.4 ' O ' ' HB3' ' A' ' 765' ' ' LEU . 18.4 p -98.09 -36.97 9.92 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -176.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.555 HD22 ' O ' ' A' ' 765' ' ' LEU . 0.6 OUTLIER 73.35 -61.62 0.49 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.142 0.577 . . . . 0.0 110.745 -177.607 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . 0.536 ' HB2' HD13 ' A' ' 765' ' ' LEU . 40.7 t80 -139.13 -68.74 0.43 Allowed 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.602 -0.686 . . . . 0.0 111.048 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 3.9 m -79.78 126.3 30.79 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.982 -0.449 . . . . 0.0 110.02 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.514 ' CE1' HD13 ' A' ' 771' ' ' LEU . 2.7 t80 -57.3 -20.42 28.16 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.967 0.413 . . . . 0.0 110.926 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.1 -40.19 95.02 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.982 0.896 . . . . 0.0 108.745 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -55.86 -29.22 59.54 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.268 178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.514 HD13 ' CE1' ' A' ' 768' ' ' TYR . 8.6 tt -59.3 -38.47 80.31 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.957 -0.464 . . . . 0.0 111.608 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -64.63 -32.83 74.67 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.333 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.75 -42.42 99.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.091 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 763' ' ' LEU . 4.0 tp -58.45 -42.19 86.83 Favored 'General case' 0 C--N 1.354 0.776 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.346 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 5.4 tp -59.06 -36.86 75.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.017 0.437 . . . . 0.0 112.163 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 26.5 mt -74.57 -44.39 51.12 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.953 -0.467 . . . . 0.0 111.529 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 34.3 pt -68.4 -37.19 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 O-C-N 122.119 -0.363 . . . . 0.0 111.312 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.74 -46.6 96.19 Favored 'Isoleucine or valine' 0 C--N 1.345 0.387 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.166 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 782' ' ' VAL . 36.7 p -64.66 -36.71 85.14 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.872 0.844 . . . . 0.0 110.813 177.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -43.87 77.24 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -178.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.71 HD11 ' CG2' ' B' ' 746' ' ' ILE . 35.3 pt -69.97 -36.73 70.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 779' ' ' THR . 21.3 m -55.76 -38.05 49.54 Favored 'Isoleucine or valine' 0 C--N 1.359 1.019 0 CA-C-N 119.427 1.012 . . . . 0.0 109.117 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.08 -50.36 69.35 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 121.826 0.822 . . . . 0.0 110.112 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.5 -41.03 98.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.461 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.86 -26.88 64.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.339 0.59 . . . . 0.0 111.188 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -65.46 -13.24 58.11 Favored Glycine 0 CA--C 1.537 1.414 0 O-C-N 122.06 -0.4 . . . . 0.0 112.493 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 26.9 mtm105 -68.77 136.04 52.18 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.822 -0.81 . . . . 0.0 109.881 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.631 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.6 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.666 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.666 HD22 ' C ' ' B' ' 660' ' ' LEU . 0.4 OUTLIER 60.2 124.12 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.173 0.511 . . . . 0.0 110.598 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' B' ' 663' ' ' LEU . 0.4 OUTLIER -174.64 29.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.604 -0.685 . . . . 0.0 112.025 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.592 HD12 HD13 ' C' ' 660' ' ' LEU . 0.3 OUTLIER 75.06 -42.74 0.49 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.799 0.809 . . . . 0.0 109.657 -179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.539 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.7 t70 -79.98 -31.87 39.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.762 0.792 . . . . 0.0 109.874 178.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.53 -41.54 79.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.507 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.592 ' CE2' HD12 ' B' ' 661' ' ' LEU . 89.1 m95 -75.02 -46.51 34.54 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.338 0.589 . . . . 0.0 111.534 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.29 71.19 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.87 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 88.3 p -62.76 -33.48 75.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.977 0.417 . . . . 0.0 111.474 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.82 -32.02 70.26 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.297 0.57 . . . . 0.0 111.081 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -62.55 -23.26 66.89 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.899 0.381 . . . . 0.0 111.918 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -81.79 -13.06 58.22 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.897 0.38 . . . . 0.0 111.813 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.6 m95 -69.98 -46.69 64.66 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.48 0.657 . . . . 0.0 110.903 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 47.8 t80 57.26 34.39 24.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.73 0.776 . . . . 0.0 110.939 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -140.7 -87.53 0.18 Allowed 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.781 -0.574 . . . . 0.0 111.139 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.408 HG12 ' CE3' ' B' ' 678' ' ' TRP . 18.5 tt -68.2 -35.98 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 O-C-N 121.57 -0.706 . . . . 0.0 112.178 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.2 m -50.38 -32.5 17.68 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.714 -0.616 . . . . 0.0 111.545 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -55.96 -44.86 78.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.625 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.0 OUTLIER -60.61 -43.7 97.14 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.838 0.828 . . . . 0.0 108.905 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.1 tp -57.86 -40.11 79.38 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.815 -178.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -100.85 -3.05 30.55 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-30 -101.47 -23.14 14.38 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.589 -0.694 . . . . 0.0 112.164 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.625 HG23 ' O ' ' B' ' 678' ' ' TRP . 28.8 pt -60.44 -35.83 65.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 O-C-N 121.875 -0.516 . . . . 0.0 110.494 178.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 22.3 ttt-85 -53.31 -47.2 69.46 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.792 -0.568 . . . . 0.0 110.098 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.485 ' N ' HD12 ' B' ' 684' ' ' ILE . 3.1 mp -75.21 -36.3 36.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.66 -27.66 66.58 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.874 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.47 -45.36 97.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 55.5 mt -64.32 -43.57 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 97.0 mt -58.64 -37.74 67.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' B' ' 685' ' ' PHE . 45.5 t -61.69 -47.46 93.24 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.936 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -51.15 -27.06 13.8 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.774 -0.579 . . . . 0.0 112.205 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 37.0 m -60.63 -44.16 96.68 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.574 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.46 -32.39 70.19 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.154 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.574 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.5 OUTLIER -57.71 -44.58 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.301 -0.875 . . . . 0.0 108.694 -178.731 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.46 -31.55 77.88 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 178.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.615 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.18 -37.82 67.55 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 122.065 0.936 . . . . 0.0 109.467 178.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.512 HH11 HD11 ' A' ' 693' ' ' ILE . 24.0 mmt180 -55.65 -28.55 56.04 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.638 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.02 -35.95 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 121.022 -1.048 . . . . 0.0 108.943 -178.987 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.615 HG12 ' O ' ' B' ' 695' ' ' LEU . 1.2 p -66.04 -30.2 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 O-C-N 121.901 -0.5 . . . . 0.0 110.269 177.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 3.4 m-85 -56.12 -30.71 62.49 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.828 -0.545 . . . . 0.0 109.532 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.81 77.29 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 177.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.38 -38.14 76.74 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.451 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 9.2 tp -58.72 -43.67 90.2 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.069 -0.395 . . . . 0.0 110.281 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 80.3 p -63.82 -31.72 73.0 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.778 0.799 . . . . 0.0 109.839 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -47.29 83.99 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 122.531 1.157 . . . . 0.0 109.142 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.465 ' HA ' HD13 ' B' ' 748' ' ' LEU . 56.1 t -70.19 -45.18 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.631 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.82 -36.04 81.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.143 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.442 HH21 ' HG3' ' B' ' 707' ' ' ARG . 4.6 ttm-85 -63.11 -49.28 75.04 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.524 1.154 . . . . 0.0 109.772 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.453 HG21 ' HD3' ' C' ' 714' ' ' PRO . 2.2 t -77.28 -44.82 30.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 114.27 -1.332 . . . . 0.0 114.183 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -70.22 -45.02 67.39 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -175.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 11.9 pt20 -104.97 -22.96 13.04 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 127.94 177.43 14.86 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . 0.48 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.0 p90 -129.97 -69.45 0.67 Allowed 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 21.8 m -62.24 159.36 40.03 Favored Pre-proline 0 N--CA 1.467 0.391 0 O-C-N 121.312 -0.867 . . . . 0.0 109.24 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.412 ' HD2' HG21 ' A' ' 708' ' ' VAL . 37.8 Cg_exo -34.26 102.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.16 1.907 . . . . 0.0 111.884 -178.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.458 ' O ' ' C ' ' B' ' 716' ' ' SER . 0.5 OUTLIER -76.28 -20.0 57.75 Favored 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -175.393 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.458 ' C ' ' O ' ' B' ' 715' ' ' LEU . 77.6 p . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.524 0.678 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.16 -26.51 62.11 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -178.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -13.13 57.68 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.07 71.21 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 121.034 -1.041 . . . . 0.0 112.124 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.44 -45.27 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -71.28 -37.07 71.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.178 0.513 . . . . 0.0 110.208 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . 0.407 ' HB3' HG12 ' B' ' 708' ' ' VAL . 52.8 m -57.13 -34.09 68.04 Favored 'General case' 0 C--O 1.231 0.084 0 CA-C-O 120.992 0.425 . . . . 0.0 110.49 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.71 ' CG2' HD11 ' A' ' 781' ' ' ILE . 23.1 mt -57.68 -16.08 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.66 -33.51 71.64 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 177.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' B' ' 705' ' ' VAL . 0.4 OUTLIER -55.73 -16.16 3.97 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.668 178.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 39.6 t -55.77 -53.69 34.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 177.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.1 -19.93 61.72 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.084 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.93 -19.87 31.53 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.834 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.22 -37.64 75.23 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.956 -0.732 . . . . 0.0 109.379 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 24.2 tp -70.0 -48.58 57.58 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 108.945 177.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.71 -34.84 73.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.805 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.03 -42.93 91.4 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.992 0.425 . . . . 0.0 111.233 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 46.6 mm -67.77 -35.62 73.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.51 -33.53 74.3 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.449 ' OD2' HD23 ' C' ' 715' ' ' LEU . 10.0 m-20 -55.92 -47.99 76.49 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.208 -0.933 . . . . 0.0 108.889 179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.45 -45.13 66.41 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.088 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -46.07 90.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -81.87 -25.4 35.09 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -176.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 2.9 p -71.23 -46.45 61.07 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.944 -1.098 . . . . 0.0 111.648 -177.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.684 ' O ' HD22 ' B' ' 774' ' ' LEU . 0.6 OUTLIER -69.45 -54.59 13.58 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -179.732 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.85 -33.94 10.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 68.52 88.42 0.11 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.743 0.782 . . . . 0.0 109.95 -176.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 58.98 -86.16 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.036 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 15.2 m -79.85 162.23 25.17 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 121.405 -0.809 . . . . 0.0 110.684 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -92.62 25.29 3.13 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.218 0.533 . . . . 0.0 111.479 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -90.98 -41.89 10.85 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.833 0.825 . . . . 0.0 109.149 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -29.46 70.34 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.32 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.37 -34.12 72.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -60.84 -43.18 98.63 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -69.56 -38.4 77.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.714 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.3 OUTLIER -67.34 -38.03 84.22 Favored 'General case' 0 C--N 1.344 0.341 0 O-C-N 121.659 -0.65 . . . . 0.0 111.308 -179.655 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . . . . . . . . . 20.0 mt -58.67 -37.17 75.43 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.577 -0.702 . . . . 0.0 111.665 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 779' ' ' THR . 1.2 pp -74.11 -34.29 63.88 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.73 -0.607 . . . . 0.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . 0.622 HD11 ' HG ' ' B' ' 774' ' ' LEU . 10.2 pt -70.39 -36.27 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.076 -1.015 . . . . 0.0 110.005 177.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.714 HG23 ' O ' ' B' ' 774' ' ' LEU . 57.9 t -55.11 -46.29 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.678 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.1 t -63.95 -35.64 81.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.484 -0.76 . . . . 0.0 109.581 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 9.7 tpt85 -61.27 -31.88 71.7 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.974 -0.454 . . . . 0.0 110.886 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.687 HG21 HG22 ' C' ' 746' ' ' ILE . 7.1 mm -61.19 -48.04 90.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 O-C-N 122.047 -0.408 . . . . 0.0 110.642 -179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.678 HG22 ' O ' ' B' ' 779' ' ' THR . 6.2 m -55.31 -38.22 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.504 -0.748 . . . . 0.0 111.11 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.61 -52.24 66.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.404 0.621 . . . . 0.0 110.76 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.1 -44.03 66.47 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.605 0.717 . . . . 0.0 111.966 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.616 HD22 ' ND2' ' C' ' 750' ' ' ASN . 0.1 OUTLIER -73.16 -14.56 61.39 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.682 -178.668 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -54.45 -40.88 70.77 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 11.5 ptp85 -100.93 130.55 46.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.334 0.587 . . . . 0.0 109.995 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.172 -0.918 . . . . 0.0 110.88 -179.228 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.592 HD13 HD12 ' B' ' 663' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.125 0.488 . . . . 0.0 110.118 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.495 ' N ' HD12 ' C' ' 661' ' ' LEU . 7.3 mp 60.45 123.02 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.723 0.773 . . . . 0.0 111.392 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 178.8 171.29 0.83 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.85 -49.35 76.98 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.174 0.988 . . . . 0.0 109.238 178.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -67.12 -23.07 65.78 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.561 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -48.73 12.06 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.361 0.601 . . . . 0.0 110.071 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -63.44 -45.21 91.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.553 0.692 . . . . 0.0 110.315 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.75 -18.01 65.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.98 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.37 -33.52 67.3 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.923 -0.486 . . . . 0.0 111.778 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.464 ' N ' HD22 ' C' ' 669' ' ' LEU . 3.9 mm? -60.15 -33.95 72.87 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -62.03 -17.58 57.78 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 121.645 -0.659 . . . . 0.0 111.801 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -86.05 -25.21 26.03 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.244 0.545 . . . . 0.0 111.133 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.409 ' CE3' HG21 ' C' ' 675' ' ' ILE . 12.5 m95 -62.84 -40.71 98.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.526 0.679 . . . . 0.0 110.237 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 58.35 34.67 24.23 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.093 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -161.03 -69.08 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.531 -0.731 . . . . 0.0 112.274 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.716 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -59.07 -37.81 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 111.168 -178.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -52.72 -33.91 50.13 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.977 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' C' ' 681' ' ' TYR . 10.2 m120 -65.69 -50.41 65.0 Favored 'General case' 0 C--O 1.223 -0.332 0 O-C-N 121.927 -0.483 . . . . 0.0 110.722 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.465 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -65.47 -44.24 87.8 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.489 0.661 . . . . 0.0 109.797 178.764 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.628 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.14 -35.63 81.41 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.884 -178.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.4 t90 -101.53 -9.77 20.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' C' ' 677' ' ' ASN . 3.1 m-85 -92.09 -21.37 20.49 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.475 -0.765 . . . . 0.0 111.201 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.545 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.2 pt -60.71 -37.05 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.822 0.344 . . . . 0.0 110.16 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 -56.9 -47.3 80.84 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.481 0.658 . . . . 0.0 109.798 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.17 -34.16 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.3 OUTLIER -60.68 -29.91 69.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.469 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.868 HG21 HD12 ' A' ' 686' ' ' ILE . 10.0 mm -60.84 -47.89 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.429 0.633 . . . . 0.0 109.415 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -61.62 -40.38 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.82 -37.68 67.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.536 HG23 ' O ' ' C' ' 685' ' ' PHE . 85.0 t -55.61 -41.12 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.55 -40.35 77.92 Favored Glycine 0 C--N 1.345 1.067 0 N-CA-C 108.813 -1.715 . . . . 0.0 108.813 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.1 -40.23 86.88 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.052 0.93 . . . . 0.0 109.373 177.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.403 HD23 HG12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -60.56 -46.68 89.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.576 -178.121 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' B' ' 693' ' ' ILE . 1.8 pp -68.53 -41.91 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 121.25 0.548 . . . . 0.0 110.375 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.609 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.28 -32.32 76.44 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 178.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.655 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.8 tt -60.08 -37.46 79.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.062 0.934 . . . . 0.0 110.158 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -55.98 -28.57 57.69 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.609 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.1 tt -58.56 -35.42 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 O-C-N 121.254 -0.904 . . . . 0.0 110.644 -177.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.668 ' O ' HG22 ' C' ' 701' ' ' VAL . 7.5 p -53.97 -29.23 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.728 -0.607 . . . . 0.0 110.621 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -54.9 -29.3 55.55 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.732 -0.605 . . . . 0.0 110.533 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.07 -37.63 74.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.668 HG22 ' O ' ' C' ' 698' ' ' VAL . 3.2 m -68.87 -35.77 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-O 121.645 0.736 . . . . 0.0 109.372 177.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.12 -37.88 84.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.035 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 22.0 m -62.97 -36.35 83.2 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.248 0.547 . . . . 0.0 110.408 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.1 -40.67 94.88 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.304 1.05 . . . . 0.0 108.841 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.434 HG22 HD23 ' C' ' 748' ' ' LEU . 87.3 t -65.36 -45.1 94.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' C' ' 710' ' ' GLN . 3.2 m120 -63.05 -36.91 85.15 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.021 0.915 . . . . 0.0 110.793 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.417 ' HD3' ' NH2' ' B' ' 707' ' ' ARG . 0.3 OUTLIER -60.04 -51.21 70.61 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.353 1.073 . . . . 0.0 110.596 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 2.1 t -78.3 -45.96 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.555 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.52 -40.24 61.88 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' C' ' 706' ' ' ASN . 0.0 OUTLIER -101.79 -21.44 14.6 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-O 121.665 0.745 . . . . 0.0 112.347 -176.572 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.46 -170.46 18.4 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -134.51 -53.36 0.83 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.863 -0.786 . . . . 0.0 112.059 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.446 ' HA ' HG21 ' B' ' 708' ' ' VAL . 0.9 OUTLIER -73.55 145.76 85.26 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.178 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . 0.453 ' HD3' HG21 ' B' ' 708' ' ' VAL . 71.2 Cg_exo -36.07 110.25 0.07 OUTLIER 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.268 1.979 . . . . 0.0 112.397 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.507 ' N ' HD22 ' C' ' 715' ' ' LEU . 2.9 mm? -74.35 -20.03 60.24 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -177.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . 0.468 ' C ' ' O ' ' C' ' 715' ' ' LEU . 67.7 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 122.058 0.932 . . . . 0.0 113.082 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 122.151 0.976 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 12.0 tpt85 -58.52 -26.31 63.36 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.095 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -55.23 -10.42 0.56 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -177.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -75.76 -27.74 58.18 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.549 -0.72 . . . . 0.0 111.687 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -58.55 -44.07 89.52 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.389 0.614 . . . . 0.0 109.786 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -71.16 -36.08 71.88 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . 0.717 ' O ' HD12 ' C' ' 748' ' ' LEU . 9.6 t -56.78 -38.71 72.88 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.687 HG22 HG21 ' B' ' 781' ' ' ILE . 6.0 mt -52.97 -22.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.84 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 5.2 ttm180 -59.35 -27.6 66.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.761 HD13 ' N ' ' C' ' 749' ' ' VAL . 0.0 OUTLIER -57.03 -22.54 39.65 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 122.185 -0.322 . . . . 0.0 111.606 179.247 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . 0.761 ' N ' HD13 ' C' ' 748' ' ' LEU . 83.5 t -55.41 -54.25 27.22 Favored 'Isoleucine or valine' 0 C--N 1.351 0.641 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.616 ' ND2' HD22 ' B' ' 785' ' ' LEU . 1.9 m-80 -72.77 -32.03 65.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.166 -1.379 . . . . 0.0 108.792 174.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.46 -20.65 38.52 Favored Glycine 0 C--N 1.341 0.834 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.806 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 80.6 p -58.77 -37.97 77.45 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.766 -0.843 . . . . 0.0 109.025 178.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 12.8 tp -67.34 -48.15 68.37 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.764 0.792 . . . . 0.0 109.986 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.14 77.13 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.427 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.7 tt -59.29 -45.32 91.59 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.858 -0.526 . . . . 0.0 111.976 -176.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 3.2 pt -73.96 -32.88 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-O 121.32 0.581 . . . . 0.0 109.822 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -69.29 -30.32 68.39 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.805 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -55.71 -49.01 74.16 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.347 -0.846 . . . . 0.0 109.907 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -70.2 -44.45 68.66 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.362 0.601 . . . . 0.0 111.29 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 2.7 mt -62.4 -40.6 97.01 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 111.463 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -78.45 -32.81 48.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.022 0.439 . . . . 0.0 111.405 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 37.5 t -66.63 -43.27 85.13 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 122.282 1.039 . . . . 0.0 110.063 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.495 HD23 HD11 ' C' ' 771' ' ' LEU . 3.2 tp -64.88 -53.57 44.59 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.08 -0.964 . . . . 0.0 113.387 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.532 ' HB2' HD12 ' C' ' 771' ' ' LEU . 23.3 t -97.82 -20.51 17.48 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 64.29 -75.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.745 0.307 . . . . 0.0 110.5 -177.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -108.5 -72.93 0.7 Allowed 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.476 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 23.6 t -133.86 175.71 9.21 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.518 0.675 . . . . 0.0 111.332 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -58.39 -38.3 77.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.152 0.501 . . . . 0.0 110.584 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -53.34 -46.49 69.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 122.105 0.955 . . . . 0.0 108.8 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 48.2 ttm-85 -72.45 -29.57 63.79 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.953 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' C' ' 764' ' ' SER . 7.5 tt -58.68 -29.66 66.78 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -178.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -56.39 -32.69 65.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -69.36 -34.52 74.7 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 118.382 -1.327 . . . . 0.0 109.666 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.595 HD21 ' CZ ' ' A' ' 742' ' ' ARG . 0.2 OUTLIER -59.93 -38.42 82.33 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.35 -36.08 72.9 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.324 1.059 . . . . 0.0 108.304 176.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -37.6 65.82 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.221 178.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.591 HD12 HD22 ' C' ' 774' ' ' LEU . 23.1 mt -63.64 -44.92 98.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.501 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.565 ' O ' HG13 ' C' ' 782' ' ' VAL . 34.5 m -66.25 -40.86 87.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.229 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.425 ' O ' HG22 ' C' ' 782' ' ' VAL . 4.1 m -63.14 -47.14 84.0 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.984 0.421 . . . . 0.0 111.881 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -39.23 83.93 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.813 -0.554 . . . . 0.0 111.871 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.405 ' HB ' HG21 ' A' ' 746' ' ' ILE . 94.3 mt -68.95 -41.94 82.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.768 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.781 HG12 HG21 ' A' ' 749' ' ' VAL . 26.4 m -55.89 -38.05 50.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.744 0 CA-C-N 119.773 1.169 . . . . 0.0 109.418 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -64.93 -42.16 94.92 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-O 121.699 0.762 . . . . 0.0 110.052 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 11.9 tp -69.47 -35.61 75.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.301 0.572 . . . . 0.0 111.502 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.846 HD23 HD22 ' A' ' 750' ' ' ASN . 26.7 tp -76.72 -28.32 55.77 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.413 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.42 -36.95 6.13 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -106.04 137.72 43.48 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.339 -0.507 . . . . 0.0 110.175 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.437 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.444 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.586 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 28.1 mt 77.61 112.23 0.07 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.989 0.9 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -176.29 -175.76 0.72 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.507 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.2 tt -56.07 -42.17 76.27 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.61 -0.681 . . . . 0.0 110.216 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.02 -34.48 64.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.125 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -73.96 -46.03 46.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.105 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -70.03 -45.95 66.1 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.976 0.417 . . . . 0.0 110.934 -179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.78 -26.55 65.27 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.985 0.421 . . . . 0.0 111.886 -179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.6 m -69.29 -32.26 71.29 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.292 0.568 . . . . 0.0 111.195 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.47 -31.71 72.48 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.447 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -59.61 -21.95 61.13 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.031 0.443 . . . . 0.0 111.267 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -75.09 -20.75 59.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.093 0.473 . . . . 0.0 111.432 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.83 -42.57 99.19 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.436 0.636 . . . . 0.0 110.973 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.4 t80 60.22 39.75 18.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.838 0.828 . . . . 0.0 110.848 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -160.98 -67.2 0.06 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.842 -0.536 . . . . 0.0 111.296 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.19 -37.13 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 122.131 -0.356 . . . . 0.0 111.83 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.0 m -52.31 -34.36 46.66 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -177.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -65.02 -49.89 68.41 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 121.507 0.67 . . . . 0.0 109.83 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.4 t90 -65.6 -41.22 93.02 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.675 0.75 . . . . 0.0 110.146 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.423 ' O ' HD11 ' A' ' 682' ' ' ILE . 0.2 OUTLIER -66.17 -36.44 83.11 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.283 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -94.56 -40.16 10.0 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -74.12 -2.7 25.65 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.692 -0.63 . . . . 0.0 112.556 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.685 HD12 ' H ' ' A' ' 683' ' ' ARG . 0.9 OUTLIER -60.98 -36.94 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 121.646 -0.659 . . . . 0.0 110.284 179.458 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.685 ' H ' HD12 ' A' ' 682' ' ' ILE . 5.9 ttt-85 -59.49 -47.26 86.19 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.009 -0.432 . . . . 0.0 110.584 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.411 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -66.76 -34.6 71.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.42 ' HA ' HD12 ' A' ' 688' ' ' ILE . 0.4 OUTLIER -59.95 -32.05 70.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.483 -179.544 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 1.004 HD12 HG21 ' C' ' 686' ' ' ILE . 15.7 mm -60.61 -46.73 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.988 0.423 . . . . 0.0 110.216 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 83.8 mt -60.78 -40.36 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' A' ' 685' ' ' PHE . 96.5 mt -59.92 -37.03 70.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.107 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 685' ' ' PHE . 97.9 t -54.58 -40.02 48.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.6 -39.94 95.75 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 7.9 m -63.4 -38.44 91.14 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.806 0.812 . . . . 0.0 109.694 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.6 -43.95 93.55 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.327 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.866 HD11 ' HE ' ' B' ' 696' ' ' ARG . 0.1 OUTLIER -68.31 -42.05 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.007 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.03 -22.5 57.94 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.91 -37.72 85.69 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.999 0.904 . . . . 0.0 109.306 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 2.4 mmt180 -55.51 -28.16 53.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.569 0.748 . . . . 0.0 111.618 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.03 -39.19 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 O-C-N 121.292 -0.88 . . . . 0.0 108.794 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.805 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.53 -31.26 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 O-C-N 121.582 -0.699 . . . . 0.0 110.184 177.219 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.422 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 3.1 m-85 -56.01 -28.91 59.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.962 0.411 . . . . 0.0 110.607 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.48 -37.43 72.91 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -178.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.805 HG22 ' O ' ' A' ' 698' ' ' VAL . 10.3 m -59.29 -35.87 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.539 0.685 . . . . 0.0 109.313 177.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.4 -37.81 62.82 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.525 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.5 m -62.65 -39.49 94.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.607 0.718 . . . . 0.0 110.091 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.576 HD22 HH22 ' A' ' 707' ' ' ARG . 0.2 OUTLIER -61.03 -41.93 97.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.558 1.17 . . . . 0.0 108.804 178.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 99.0 t -68.87 -37.07 76.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.317 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -62.56 -39.92 95.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.034 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.576 HH22 HD22 ' A' ' 704' ' ' LEU . 5.2 ttm105 -57.36 -48.44 79.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 122.348 1.071 . . . . 0.0 110.349 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' B' ' 714' ' ' PRO . 2.1 t -72.94 -44.53 57.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.022 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -73.33 -14.47 61.3 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -178.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 8.35 44.47 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 73.14 20.79 80.06 Favored Glycine 0 CA--C 1.541 1.687 0 O-C-N 121.665 -0.647 . . . . 0.0 112.131 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 68.22 -129.29 0.12 Allowed 'General case' 0 CA--C 1.568 1.635 0 O-C-N 121.868 -0.783 . . . . 0.0 111.272 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 5.5 p -62.62 159.26 44.54 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 120.974 -1.078 . . . . 0.0 111.206 -178.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -45.15 97.96 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.46 1.44 . . . . 0.0 112.127 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.61 -20.41 16.35 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.423 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.85 0 O-C-N 121.766 -0.584 . . . . 0.0 112.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 N--CA 1.472 0.631 0 CA-C-O 121.917 0.865 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 7.7 mtt-85 -58.63 -26.33 63.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.746 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -54.85 -16.97 3.02 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.8 -0.563 . . . . 0.0 111.225 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.532 ' O ' HD12 ' A' ' 746' ' ' ILE . 53.1 ttp85 -74.79 -46.01 39.75 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.759 -0.588 . . . . 0.0 110.527 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.91 -45.14 93.51 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.504 0.669 . . . . 0.0 110.587 -178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.41 -36.56 71.38 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 748' ' ' LEU . 98.0 p -62.22 -36.14 81.03 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.703 HG12 HG12 ' C' ' 778' ' ' VAL . 1.2 mp -55.79 -46.76 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 120.577 -1.327 . . . . 0.0 110.283 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.653 ' HB3' HD22 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -64.41 -2.2 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.758 -177.165 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.65 ' O ' HD13 ' A' ' 748' ' ' LEU . 1.7 tm? -59.33 -15.53 16.82 Favored 'General case' 0 C--N 1.368 1.398 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.621 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.304 2.0 t -53.12 -54.0 19.57 Favored 'Isoleucine or valine' 0 C--N 1.345 0.375 0 C-N-CA 125.13 1.372 . . . . 0.0 107.439 178.478 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.621 ' ND2' HG12 ' A' ' 749' ' ' VAL . 1.5 m-80 -73.32 -14.34 61.28 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.324 175.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.608 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -57.16 -19.41 31.54 Favored Glycine 0 C--O 1.222 -0.622 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.519 -179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 94.0 p -57.64 -37.86 74.06 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 117.803 0.801 . . . . 0.0 109.147 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 34.4 tp -62.55 -51.07 68.84 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -63.8 -35.14 79.63 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 112.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.4 tt -59.48 -45.45 91.61 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.002 -0.436 . . . . 0.0 111.963 -177.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 56.2 mt -61.84 -33.52 58.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.2 -30.49 68.68 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.536 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.413 ' HB3' ' CB ' ' B' ' 710' ' ' GLN . 5.1 m-20 -55.68 -48.93 74.23 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.319 -0.863 . . . . 0.0 109.271 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -70.64 -43.46 69.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.405 0.622 . . . . 0.0 111.757 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.42 -32.97 74.81 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.308 0.575 . . . . 0.0 112.114 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -74.42 -18.55 60.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 1.2 t -77.37 -46.4 22.93 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.579 -0.7 . . . . 0.0 111.634 -179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.745 ' HA ' HD13 ' A' ' 774' ' ' LEU . 8.0 mp -69.09 -55.82 9.59 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -47.24 5.19 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.255 1.026 . . . . 0.0 112.15 -178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.431 ' O ' HD23 ' A' ' 765' ' ' LEU . 3.6 tt 84.22 -52.96 0.12 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.464 -176.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -134.43 -72.6 0.48 Allowed 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.78 -0.575 . . . . 0.0 110.668 178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.9 152.93 19.83 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.884 -0.51 . . . . 0.0 110.323 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.511 ' CE2' HD13 ' A' ' 771' ' ' LEU . 0.2 OUTLIER -67.03 -24.86 66.05 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.942 0.401 . . . . 0.0 110.897 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.18 -42.19 65.99 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.731 0.777 . . . . 0.0 109.54 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -62.95 -30.08 71.29 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.114 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.511 HD13 ' CE2' ' A' ' 768' ' ' TYR . 2.8 tt -59.87 -42.4 93.63 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.859 -0.525 . . . . 0.0 109.709 -178.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -64.72 -33.51 76.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.658 0.742 . . . . 0.0 109.236 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -43.44 98.82 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.919 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.745 HD13 ' HA ' ' A' ' 763' ' ' LEU . 7.7 tt -58.38 -38.46 77.36 Favored 'General case' 0 C--N 1.349 0.544 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.172 -179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 13.1 mt -58.44 -36.88 74.34 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.774 -0.579 . . . . 0.0 112.028 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.8 -43.07 72.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.914 -0.491 . . . . 0.0 112.173 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 20.5 pt -65.19 -37.69 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.466 ' HA ' HD12 ' A' ' 781' ' ' ILE . 73.0 t -56.09 -45.42 80.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 O-C-N 121.98 -0.45 . . . . 0.0 110.631 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.827 ' O ' HG22 ' A' ' 782' ' ' VAL . 19.9 p -63.62 -48.39 77.49 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.023 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -67.54 -31.34 71.37 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.629 ' CD1' HD13 ' B' ' 746' ' ' ILE . 36.8 mt -53.66 -36.21 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.827 HG22 ' O ' ' A' ' 779' ' ' THR . 5.2 m -55.63 -37.99 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.368 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -65.45 -44.68 86.51 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 121.503 0.668 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 13.1 tp -69.45 -38.2 77.68 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.158 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.97 -27.23 26.62 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.0 0.429 . . . . 0.0 111.475 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.66 -31.9 3.98 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 111.924 -0.47 . . . . 0.0 111.924 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -89.91 111.37 22.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.67 0.747 . . . . 0.0 110.246 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.799 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.581 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.5 mm? 63.53 119.6 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.624 0.726 . . . . 0.0 110.055 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 178.57 177.55 0.45 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.479 0.657 . . . . 0.0 110.172 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.485 HD23 ' N ' ' B' ' 664' ' ' ASP . 9.5 tt -48.94 -62.52 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.793 0.806 . . . . 0.0 111.379 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.485 ' N ' HD23 ' B' ' 663' ' ' LEU . 9.0 t70 -64.78 -21.16 66.72 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.408 -178.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -79.97 -43.91 21.19 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.924 -0.485 . . . . 0.0 110.677 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -64.81 -46.09 83.47 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.665 0.745 . . . . 0.0 109.964 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.09 -23.74 67.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.771 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 42.8 p -68.45 -30.84 69.79 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.838 -0.539 . . . . 0.0 111.274 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.0 -33.19 72.86 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.485 0.659 . . . . 0.0 110.779 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 64.3 m95 -59.57 -18.87 44.43 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.366 -179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -84.92 -29.5 25.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.343 0.592 . . . . 0.0 110.744 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 12.7 m95 -57.6 -47.56 81.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.354 0.597 . . . . 0.0 110.74 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 18.8 t80 59.52 28.11 17.43 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.334 0.588 . . . . 0.0 111.323 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -138.68 -78.23 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.83 -0.544 . . . . 0.0 111.069 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -64.64 -36.98 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.681 -0.637 . . . . 0.0 111.254 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.7 m -51.81 -34.31 39.6 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.073 -0.392 . . . . 0.0 111.916 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -63.36 -50.15 71.08 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 109.575 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.624 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.6 t90 -65.65 -40.58 92.61 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-O 121.889 0.852 . . . . 0.0 109.879 178.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -35.68 81.61 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 7.7 t90 -101.83 -47.01 4.74 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -59.0 -15.1 11.45 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.61 -0.681 . . . . 0.0 112.224 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.783 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.3 pp -60.56 -36.28 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 O-C-N 121.623 -0.673 . . . . 0.0 110.459 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . 0.783 ' N ' HD12 ' B' ' 682' ' ' ILE . 12.9 ttt-85 -53.85 -47.39 71.01 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.442 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -68.68 -37.34 77.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -28.25 67.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.786 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.707 HD12 HG21 ' A' ' 686' ' ' ILE . 16.9 mm -60.7 -49.6 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 O-C-N 121.781 -0.575 . . . . 0.0 109.924 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.3 mt -63.37 -39.59 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.09 -37.95 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.66 -48.4 87.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.16 -26.75 9.51 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 7.4 m -60.06 -43.85 95.14 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.579 HD12 ' N ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.56 -31.84 69.8 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.413 -0.805 . . . . 0.0 112.374 -177.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.579 ' N ' HD12 ' B' ' 692' ' ' LEU . 1.1 pp -57.05 -46.13 84.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.452 -0.78 . . . . 0.0 109.757 -177.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.73 -31.36 77.79 Favored Glycine 0 CA--C 1.54 1.624 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.455 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.7 OUTLIER -55.08 -37.19 66.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.906 0.86 . . . . 0.0 110.434 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.866 ' HE ' HD11 ' A' ' 693' ' ' ILE . 17.3 mmt180 -55.14 -28.23 51.17 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.703 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -58.53 -36.55 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 O-C-N 120.813 -1.179 . . . . 0.0 108.665 -178.208 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.455 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -67.4 -30.84 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 121.418 -0.801 . . . . 0.0 109.65 176.472 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.7 m-85 -56.37 -30.64 62.95 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.759 -0.588 . . . . 0.0 109.724 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.64 -37.4 75.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -43.16 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 3.8 tp -59.69 -37.97 80.28 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 121.121 0.486 . . . . 0.0 109.767 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.3 m -62.76 -32.96 74.21 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.219 0.533 . . . . 0.0 109.594 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.484 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.1 OUTLIER -64.18 -40.59 96.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.052 0.929 . . . . 0.0 108.617 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.495 HG22 HD22 ' B' ' 748' ' ' LEU . 58.6 t -67.88 -46.17 82.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.564 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.87 -36.61 83.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.8 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -68.34 -50.18 55.11 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.4 -41.98 30.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.645 0.736 . . . . 0.0 112.434 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -58.01 -44.99 87.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.514 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.413 ' CB ' ' HB3' ' A' ' 758' ' ' ASP . 1.2 pt20 -104.61 -25.0 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 122.333 1.063 . . . . 0.0 113.24 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.95 153.55 8.0 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.511 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -85.85 -33.24 21.35 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 122.05 -0.676 . . . . 0.0 112.135 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.02 155.43 52.49 Favored Pre-proline 0 N--CA 1.471 0.601 0 CA-C-O 118.454 -0.784 . . . . 0.0 109.663 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 708' ' ' VAL . 59.8 Cg_exo -36.83 138.24 0.23 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.809 1.673 . . . . 0.0 112.285 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' B' ' 716' ' ' SER . 11.4 tp -100.55 -19.3 16.22 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 715' ' ' LEU . 6.9 t . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 122.346 1.07 . . . . 0.0 112.756 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.547 0.833 0 CA-C-O 122.045 0.926 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 3.1 ttp85 -72.42 -26.22 61.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.898 0.856 . . . . 0.0 111.454 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.32 -6.09 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -176.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.829 ' O ' HD12 ' B' ' 746' ' ' ILE . 60.8 mtm-85 -55.33 -39.11 69.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.248 0.931 . . . . 0.0 110.492 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.16 -43.72 87.56 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.165 0.507 . . . . 0.0 109.82 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.3 -42.86 68.14 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.567 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 93.8 p -56.54 -37.75 70.93 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.862 -0.524 . . . . 0.0 110.903 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.829 HD12 ' O ' ' B' ' 742' ' ' ARG . 1.4 mp -58.99 -10.28 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.913 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.836 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.429 ' HD2' ' HG3' ' C' ' 714' ' ' PRO . 0.0 OUTLIER -59.0 -27.11 65.12 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 121.211 -0.93 . . . . 0.0 108.863 177.683 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.495 HD22 HG22 ' B' ' 705' ' ' VAL . 33.9 tp -54.47 -21.91 11.27 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.643 -177.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 92.4 t -55.39 -54.29 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -73.02 -24.7 60.76 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.282 174.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.95 -19.76 31.25 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.025 -0.989 . . . . 0.0 113.159 -176.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 35.6 t -58.17 -37.63 75.08 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.387 1.094 . . . . 0.0 108.993 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 33.1 tp -69.27 -51.07 41.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.152 0.501 . . . . 0.0 110.595 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.63 76.06 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.78 -45.37 92.51 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.574 -0.704 . . . . 0.0 111.852 -176.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . 0.41 HG22 HD12 ' B' ' 760' ' ' LEU . 32.1 mm -64.99 -31.2 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.584 0.707 . . . . 0.0 109.24 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.2 -30.39 68.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.947 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -55.21 -49.15 72.67 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.295 -0.878 . . . . 0.0 108.755 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.67 -44.6 66.69 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.455 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . 0.41 HD12 HG22 ' B' ' 756' ' ' ILE . 24.6 mt -68.1 -46.27 71.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -177.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -63.38 -42.77 98.86 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . 0.406 ' O ' HD22 ' B' ' 774' ' ' LEU . 2.1 p -68.42 -45.45 72.58 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.443 0.639 . . . . 0.0 111.073 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.446 HD23 HD11 ' B' ' 771' ' ' LEU . 0.2 OUTLIER -68.67 -53.75 20.45 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.829 -0.544 . . . . 0.0 112.39 -179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.9 p -98.03 -49.35 4.79 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 76.89 92.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.898 0.856 . . . . 0.0 110.412 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 3.1 t80 71.45 -72.93 0.1 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.177 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 19.2 p -98.67 163.28 12.71 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.743 -0.598 . . . . 0.0 111.376 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.87 -33.51 21.24 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.661 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.81 -38.11 64.23 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 122.167 0.984 . . . . 0.0 109.156 178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 9.6 tpt85 -59.27 -29.64 67.72 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.856 178.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.446 HD11 HD23 ' B' ' 763' ' ' LEU . 8.0 tt -59.61 -37.73 79.39 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 110.706 -178.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -58.53 -35.62 72.57 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 121.128 0.49 . . . . 0.0 110.081 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -69.25 -48.98 60.32 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.138 0.494 . . . . 0.0 110.188 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.413 ' O ' HG23 ' B' ' 778' ' ' VAL . 0.1 OUTLIER -61.4 -37.73 84.5 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.747 0.784 . . . . 0.0 110.137 179.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.62 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.6 OUTLIER -57.69 -36.92 72.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.58 -178.652 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.15 -33.28 69.9 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 122.19 -0.319 . . . . 0.0 111.45 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 6.3 pt -70.15 -36.88 69.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 O-C-N 121.839 -0.538 . . . . 0.0 110.317 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.413 HG23 ' O ' ' B' ' 774' ' ' LEU . 41.6 t -59.72 -46.19 93.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 O-C-N 121.526 -0.734 . . . . 0.0 110.344 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.791 ' O ' HG22 ' B' ' 782' ' ' VAL . 3.2 t -63.33 -48.18 79.09 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.934 -0.479 . . . . 0.0 112.226 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.5 -31.68 71.96 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.756 -0.59 . . . . 0.0 111.445 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 22.6 mt -58.34 -36.32 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 121.88 -0.513 . . . . 0.0 110.652 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.791 HG22 ' O ' ' B' ' 779' ' ' THR . 5.9 m -53.87 -38.26 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 O-C-N 121.593 -0.692 . . . . 0.0 110.246 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.28 -41.61 96.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.4 0.619 . . . . 0.0 110.573 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.73 -44.13 97.5 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.295 0.569 . . . . 0.0 110.954 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . . . . . . . . . 30.3 tp -79.51 -24.95 41.91 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.007 0.432 . . . . 0.0 110.64 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.51 -43.04 10.43 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -97.78 113.66 25.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.686 0.755 . . . . 0.0 109.776 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.348 -178.564 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 122.398 1.094 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.54 169.26 24.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.884 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -174.58 167.41 3.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.572 0.701 . . . . 0.0 110.532 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.588 HD13 ' N ' ' C' ' 664' ' ' ASP . 0.2 OUTLIER -56.2 -48.69 75.9 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.067 0.937 . . . . 0.0 109.375 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.588 ' N ' HD13 ' C' ' 663' ' ' LEU . 9.4 t70 -67.2 -28.96 68.51 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.396 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -71.22 -48.74 49.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.028 0.442 . . . . 0.0 111.018 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -56.84 -46.19 81.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.217 0.532 . . . . 0.0 110.486 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.35 85.65 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.185 0.516 . . . . 0.0 111.448 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 25.5 p -57.78 -34.5 69.65 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.138 0.495 . . . . 0.0 111.293 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 14.8 mt -60.52 -29.06 68.87 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.139 -0.351 . . . . 0.0 111.293 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 51.1 m95 -60.91 -21.11 63.05 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.909 -0.495 . . . . 0.0 110.993 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -84.98 -5.76 59.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 121.03 0.443 . . . . 0.0 111.352 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.43 ' O ' HG22 ' C' ' 675' ' ' ILE . 13.9 m95 -89.86 30.65 1.03 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.323 0.582 . . . . 0.0 110.617 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -16.56 135.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 91.52 -48.93 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.688 1.595 . . . . 0.0 111.651 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.662 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -68.82 -42.39 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.535 0.683 . . . . 0.0 111.571 -179.34 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -52.73 -33.69 49.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.568 -178.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -60.11 -49.92 75.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.391 0.615 . . . . 0.0 109.704 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.669 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.8 OUTLIER -65.81 -42.76 90.25 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.685 0.755 . . . . 0.0 109.693 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.466 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -63.31 -35.8 81.57 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.391 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -101.61 -23.27 14.29 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -177.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -83.09 -16.07 48.33 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.374 -0.829 . . . . 0.0 112.22 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.669 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.5 pp -60.53 -36.47 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 O-C-N 122.043 -0.411 . . . . 0.0 110.226 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.645 ' N ' HD12 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -59.88 -46.86 87.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.75 0.786 . . . . 0.0 109.789 179.397 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.434 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -73.18 -31.33 34.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 CA-C-O 121.423 0.63 . . . . 0.0 109.71 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -28.28 68.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.436 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 1.004 HG21 HD12 ' A' ' 686' ' ' ILE . 8.3 mm -61.79 -42.74 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 121.41 0.624 . . . . 0.0 109.562 -179.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 66.4 mt -65.19 -37.64 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.92 -38.23 72.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 81.6 t -55.7 -40.41 60.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . 0.424 ' O ' HG13 ' C' ' 693' ' ' ILE . . . -55.13 -40.43 74.42 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 177.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 5.6 m -66.35 -38.32 87.34 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.019 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.0 tp -60.21 -46.32 90.16 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.572 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.424 HG13 ' O ' ' C' ' 690' ' ' GLY . 1.9 pp -67.88 -41.8 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 O-C-N 121.928 -0.483 . . . . 0.0 111.005 -178.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.698 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.39 -26.57 64.36 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.608 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.9 tt -66.07 -38.74 89.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.938 0.875 . . . . 0.0 110.138 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.15 -28.69 58.97 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.698 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.2 tt -58.77 -35.36 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 O-C-N 121.416 -0.802 . . . . 0.0 110.99 -176.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.608 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.9 p -53.89 -29.77 18.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 O-C-N 121.495 -0.753 . . . . 0.0 110.474 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -55.91 -31.68 63.1 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.873 -0.517 . . . . 0.0 110.268 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.82 -37.64 79.76 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -45.13 88.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -56.69 -39.12 73.25 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.753 178.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.4 m -63.33 -38.84 92.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.997 0.427 . . . . 0.0 110.144 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.447 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.2 OUTLIER -63.19 -41.98 99.28 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.741 HG13 HD21 ' C' ' 748' ' ' LEU . 98.8 t -61.69 -45.61 98.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -62.84 -36.6 83.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.274 1.035 . . . . 0.0 111.055 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.413 ' HD2' ' C ' ' C' ' 707' ' ' ARG . 5.6 tmm_? -57.08 -51.06 70.79 Favored 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 121.301 -0.874 . . . . 0.0 110.654 -177.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -44.37 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -73.05 -44.19 61.03 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -103.28 -22.05 13.76 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 128.52 164.74 11.62 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . 0.484 ' O ' HD11 ' B' ' 704' ' ' LEU . 31.4 p90 -114.08 -47.62 2.94 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.474 0.654 . . . . 0.0 111.779 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 9.7 p -97.99 159.5 30.68 Favored Pre-proline 0 C--O 1.233 0.232 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . 0.429 ' HG3' ' HD2' ' B' ' 747' ' ' ARG . 27.3 Cg_exo -33.47 121.35 0.12 Allowed 'Trans proline' 0 N--CA 1.5 1.86 0 C-N-CA 122.19 1.927 . . . . 0.0 112.424 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.76 16.61 23.44 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 O-C-N 121.004 -1.06 . . . . 0.0 110.031 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 N--CA 1.467 0.419 0 CA-C-O 121.935 0.874 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 17.8 tpt85 -64.26 -30.73 71.77 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.333 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.75 -34.03 64.83 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.039 0.447 . . . . 0.0 111.05 -179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -58.1 -37.41 74.47 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 122.191 -0.318 . . . . 0.0 111.635 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -58.27 -39.28 78.81 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.461 -0.774 . . . . 0.0 108.975 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -36.46 71.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.376 177.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 54.2 p -61.7 -44.8 96.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.9 -0.5 . . . . 0.0 110.924 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.57 -28.67 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.286 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 4.9 mtm105 -59.81 -22.81 62.7 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.55 -0.719 . . . . 0.0 110.021 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.741 HD21 HG13 ' C' ' 705' ' ' VAL . 0.1 OUTLIER -67.11 -18.58 65.37 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.031 0.444 . . . . 0.0 110.18 178.427 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 46.4 t -55.74 -54.66 23.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.579 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -72.9 -21.07 60.97 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.338 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.86 -20.19 32.25 Favored Glycine 0 C--N 1.344 0.993 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.518 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.1 p -58.15 -37.62 74.99 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.909 -0.76 . . . . 0.0 109.103 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 13.6 tp -65.63 -51.32 60.48 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 177.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -59.01 -34.91 72.43 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.356 0.598 . . . . 0.0 111.854 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.476 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.5 tt -59.04 -45.34 90.98 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.0 0.429 . . . . 0.0 111.302 -177.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 50.9 mt -72.08 -37.28 59.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.509 0.671 . . . . 0.0 109.689 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.33 -31.42 69.85 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.78 -45.88 78.05 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.146 -0.971 . . . . 0.0 110.241 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . 0.721 ' O ' HD12 ' C' ' 763' ' ' LEU . 22.8 t70 -70.29 -42.86 71.5 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.427 0.632 . . . . 0.0 110.976 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.31 -36.81 83.88 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -82.41 -31.37 29.64 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 68.9 m -73.37 -45.84 52.62 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.538 -0.726 . . . . 0.0 112.751 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.77 HD13 ' H ' ' C' ' 764' ' ' SER . 0.0 OUTLIER -68.57 -39.0 81.2 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.689 -0.632 . . . . 0.0 112.61 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.77 ' H ' HD13 ' C' ' 763' ' ' LEU . 4.9 m -91.26 -34.27 15.03 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.832 -0.543 . . . . 0.0 111.53 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.06 60.88 1.43 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 122.304 1.05 . . . . 0.0 109.438 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 39.6 t80 60.53 160.53 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.327 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 50.4 m 55.69 -160.02 0.2 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -132.83 -34.39 1.14 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.371 -0.83 . . . . 0.0 110.463 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -53.5 -27.55 26.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.682 0.753 . . . . 0.0 109.888 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -71.48 -30.14 65.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.46 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.564 HD12 HD21 ' C' ' 763' ' ' LEU . 6.2 tt -59.66 -30.84 69.03 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.842 -0.536 . . . . 0.0 110.038 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -32.83 67.76 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.657 0.742 . . . . 0.0 109.2 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -63.33 -34.37 77.56 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.516 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.519 HD13 ' HA ' ' C' ' 763' ' ' LEU . 9.0 tp -57.88 -38.35 75.62 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 121.804 -0.56 . . . . 0.0 110.287 -179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 49.8 mt -58.44 -39.47 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.769 0.795 . . . . 0.0 109.814 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.56 -41.69 60.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.666 0.746 . . . . 0.0 110.691 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.13 -41.57 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.02 -178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.703 HG12 HG12 ' A' ' 746' ' ' ILE . 27.9 m -65.09 -39.69 86.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 O-C-N 121.514 -0.741 . . . . 0.0 110.766 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.759 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.0 OUTLIER -63.72 -45.19 91.07 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 122.041 -0.412 . . . . 0.0 111.489 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -31.63 71.62 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.552 HD13 ' HB ' ' A' ' 746' ' ' ILE . 61.4 mt -64.54 -39.44 85.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 119.051 -0.5 . . . . 0.0 112.157 -178.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.759 HG22 ' O ' ' C' ' 779' ' ' THR . 29.2 m -53.16 -37.95 29.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 CA-C-N 119.846 1.203 . . . . 0.0 110.126 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.01 -41.45 99.57 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.157 0.503 . . . . 0.0 111.446 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 41.3 tp -70.17 -44.51 68.64 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.653 HD22 ' HB3' ' A' ' 747' ' ' ARG . 0.8 OUTLIER -87.28 -15.8 37.02 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.599 1.091 . . . . 0.0 111.188 -179.472 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -56.28 -50.15 63.99 Favored Glycine 0 C--N 1.345 1.039 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 178.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 137.14 52.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.015 179.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.292 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.658 ' N ' HD23 ' C' ' 663' ' ' LEU . 4.8 tp . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 61.4 mt 56.32 92.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.861 0.838 . . . . 0.0 110.927 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -164.58 178.14 7.57 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.054 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.464 HD12 ' N ' ' B' ' 660' ' ' LEU . 2.9 tt -54.79 -43.93 73.28 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.579 0.704 . . . . 0.0 110.441 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.38 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -73.95 -45.46 50.17 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.197 0.522 . . . . 0.0 110.943 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -70.18 -46.34 64.81 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.803 0.335 . . . . 0.0 111.174 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.75 -28.38 68.99 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.022 0.439 . . . . 0.0 112.159 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.3 t -65.35 -36.84 85.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.367 0.603 . . . . 0.0 111.022 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.5 HD23 ' OG1' ' A' ' 676' ' ' THR . 0.7 OUTLIER -65.48 -23.65 66.96 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -59.62 -27.85 66.68 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.497 -0.752 . . . . 0.0 111.508 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -67.46 -24.03 65.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.883 -0.51 . . . . 0.0 111.625 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -54.96 -47.58 74.34 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.232 0.539 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 76.3 t80 60.77 7.49 1.46 Allowed 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -118.01 -73.77 0.63 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.172 -0.955 . . . . 0.0 111.091 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.62 HG12 HD23 ' A' ' 679' ' ' LEU . 5.7 tt -68.06 -36.02 73.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 O-C-N 121.959 -0.463 . . . . 0.0 111.78 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.5 ' OG1' HD23 ' A' ' 669' ' ' LEU . 4.3 m -50.99 -33.58 25.35 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 122.033 -0.417 . . . . 0.0 111.351 -176.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.88 -49.2 75.79 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.544 0.688 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.545 ' O ' HG23 ' A' ' 682' ' ' ILE . 0.1 OUTLIER -65.51 -44.29 87.46 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 121.659 -0.651 . . . . 0.0 110.498 179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.62 HD23 HG12 ' A' ' 675' ' ' ILE . 3.4 mm? -66.18 -39.36 89.66 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.2 t90 -89.27 -8.49 53.3 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -107.67 -8.5 16.1 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.551 -0.718 . . . . 0.0 111.833 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 678' ' ' TRP . 1.6 pt -60.53 -36.67 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 121.665 -0.647 . . . . 0.0 109.412 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.6 ttt-85 -53.45 -47.14 69.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 109.814 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.18 -36.09 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.451 ' O ' HG23 ' A' ' 689' ' ' VAL . 1.2 t80 -59.83 -28.59 67.61 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.485 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.941 HD12 HG21 ' C' ' 686' ' ' ILE . 14.1 mm -61.67 -51.98 66.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.358 0.599 . . . . 0.0 109.76 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.18 -36.46 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.728 0.775 . . . . 0.0 109.384 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -36.95 58.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 685' ' ' PHE . 95.9 t -54.06 -40.07 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.21 -39.67 82.08 Favored Glycine 0 CA--C 1.532 1.119 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.8 m -67.28 -38.51 85.18 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.116 0.96 . . . . 0.0 109.596 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 tp -59.64 -46.12 89.97 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.172 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.55 HG21 HG22 ' B' ' 693' ' ' ILE . 1.4 pp -68.15 -43.29 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 122.045 -0.41 . . . . 0.0 111.333 -177.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.68 -23.43 60.88 Favored Glycine 0 CA--C 1.54 1.596 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.31 -37.98 79.11 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.256 1.027 . . . . 0.0 108.957 178.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.674 ' HG3' HD11 ' C' ' 693' ' ' ILE . 15.5 mmt180 -55.99 -28.45 57.24 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.599 0.76 . . . . 0.0 112.541 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.36 -41.27 83.79 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.366 -0.833 . . . . 0.0 109.206 -177.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.755 ' O ' HG22 ' A' ' 701' ' ' VAL . 0.5 OUTLIER -67.51 -30.37 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.501 -0.75 . . . . 0.0 109.956 177.135 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.9 OUTLIER -55.49 -28.56 55.31 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.255 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -37.01 71.3 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 698' ' ' VAL . 4.9 m -58.83 -36.76 62.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 O-C-N 121.59 -0.694 . . . . 0.0 109.316 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 2.6 tp -56.15 -38.22 70.55 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 19.4 m -64.06 -39.3 93.78 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-O 121.563 0.697 . . . . 0.0 109.922 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.503 HD22 ' NH1' ' A' ' 707' ' ' ARG . 0.5 OUTLIER -60.84 -44.72 96.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.571 1.176 . . . . 0.0 108.533 178.337 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.984 HG22 HD11 ' A' ' 748' ' ' LEU . 40.1 t -64.36 -42.86 96.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 114.411 -1.268 . . . . 0.0 109.128 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -62.59 -42.12 99.37 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.285 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.503 ' NH1' HD22 ' A' ' 704' ' ' LEU . 8.6 mtm105 -60.89 -45.8 93.17 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 122.138 0.971 . . . . 0.0 111.474 -178.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.435 HG21 ' HA ' ' B' ' 713' ' ' SER . 3.0 t -75.89 -44.66 38.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.221 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -73.76 -14.69 61.16 Favored 'General case' 0 CA--C 1.553 1.076 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -16.23 28.66 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.04 -1.037 . . . . 0.0 113.06 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 104.98 34.36 3.49 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 121.639 -0.663 . . . . 0.0 111.98 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 55.58 -136.03 1.27 Allowed 'General case' 0 CA--C 1.561 1.4 0 O-C-N 122.031 -0.688 . . . . 0.0 110.828 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . . . . . . . . . 17.1 m -62.86 157.76 57.78 Favored Pre-proline 0 C--N 1.35 0.611 0 O-C-N 120.859 -1.151 . . . . 0.0 112.106 -178.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.433 ' HD2' HG21 ' C' ' 708' ' ' VAL . 73.0 Cg_exo -44.6 103.89 0.05 OUTLIER 'Trans proline' 0 N--CA 1.482 0.815 0 C-N-CA 121.763 1.642 . . . . 0.0 112.799 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.541 ' H ' HD23 ' A' ' 715' ' ' LEU . 1.9 pt? -105.95 -20.61 13.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.564 0.697 . . . . 0.0 111.594 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.692 ' HA ' ' HB1' ' C' ' 754' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 C-N-CA 123.378 0.671 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 14.0 ttm-85 -59.3 -26.73 65.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.481 -179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -9.06 0.65 Allowed 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.746 -0.596 . . . . 0.0 112.389 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.4 ttm105 -60.0 -41.73 92.72 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.411 -0.805 . . . . 0.0 109.48 179.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.593 ' HB3' HD12 ' C' ' 781' ' ' ILE . 0.9 OUTLIER -68.08 -41.11 82.38 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.534 0.683 . . . . 0.0 109.335 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -60.04 -46.83 88.23 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.279 -0.888 . . . . 0.0 108.955 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 4.8 p -69.15 -26.94 65.12 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.135 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.55 ' HB ' HG21 ' C' ' 781' ' ' ILE . 30.7 mt -74.89 -47.41 37.43 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-O 116.565 -1.683 . . . . 0.0 112.014 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.55 ' HB3' HD22 ' C' ' 785' ' ' LEU 0.343 14.1 ttt180 -73.45 -3.85 30.04 Favored 'General case' 0 C--N 1.361 1.109 0 CA-C-N 122.721 2.509 . . . . 0.0 111.47 -178.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.984 HD11 HG22 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -56.46 -15.4 4.14 Favored 'General case' 0 CA--C 1.577 1.992 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 169.601 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.568 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.293 1.5 t -53.66 -54.2 20.81 Favored 'Isoleucine or valine' 0 C--N 1.363 1.182 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 175.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.568 ' ND2' HG12 ' A' ' 749' ' ' VAL . 1.6 m-80 -72.52 -22.43 61.03 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.158 -1.383 . . . . 0.0 108.686 175.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.87 -19.39 29.26 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.1 t -57.45 -37.11 72.3 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 51.6 tp -61.31 -49.25 77.76 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.0 -34.75 72.21 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.657 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.474 ' C ' HD23 ' A' ' 755' ' ' LEU . 8.2 tt -58.67 -45.53 89.18 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.876 -0.515 . . . . 0.0 112.189 -176.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 40.3 mt -61.55 -32.24 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.3 m-90 -69.24 -30.38 68.51 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.76 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.71 ' OD2' HD22 ' B' ' 715' ' ' LEU . 6.3 m-20 -55.51 -44.9 77.03 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.855 0.836 . . . . 0.0 109.248 179.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -70.41 -42.84 71.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.573 0.701 . . . . 0.0 111.372 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 22.6 mt -68.98 -29.85 68.14 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -79.16 -30.13 43.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 4.9 t -75.26 -45.02 42.71 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.951 0.881 . . . . 0.0 111.61 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.65 ' O ' HD22 ' A' ' 774' ' ' LEU . 0.5 OUTLIER -59.9 -53.59 56.06 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.232 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 3.3 m -97.9 -24.11 15.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.353 -0.842 . . . . 0.0 113.237 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . . . . . . . . . 25.6 mt 66.55 -73.22 0.08 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.906 0.384 . . . . 0.0 109.989 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -135.8 133.76 38.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 109.516 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 6.6 m 58.48 168.74 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.506 ' CE1' HD22 ' A' ' 771' ' ' LEU . 5.2 t80 -91.14 -17.56 25.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 120.963 0.411 . . . . 0.0 111.813 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.8 -34.0 77.15 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.004 0.907 . . . . 0.0 109.773 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -62.64 -29.53 70.7 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.003 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.529 HD11 HD23 ' A' ' 763' ' ' LEU . 40.2 tp -59.61 -45.52 91.68 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.891 -0.506 . . . . 0.0 111.928 -177.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 1.3 ptt85 -64.02 -33.74 76.43 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.708 -0.797 . . . . 0.0 109.45 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -69.33 -39.59 78.08 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.78 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.65 HD22 ' O ' ' A' ' 763' ' ' LEU . 1.8 tp -59.35 -38.49 80.52 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.971 -0.456 . . . . 0.0 111.2 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.11 -36.75 75.7 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 14.5 mt -67.86 -44.31 77.42 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.475 ' O ' HG13 ' A' ' 781' ' ' ILE . 6.0 pt -58.1 -36.5 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.409 HG22 HD11 ' B' ' 746' ' ' ILE . 91.7 t -53.54 -44.53 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 O-C-N 121.911 -0.493 . . . . 0.0 109.904 -177.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 51.7 p -63.79 -36.8 85.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.117 0.96 . . . . 0.0 109.649 177.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -34.11 76.55 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.832 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 777' ' ' ILE . 55.8 mt -68.76 -42.73 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.664 -0.647 . . . . 0.0 110.86 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.29 -38.55 82.43 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 O-C-N 121.467 -0.77 . . . . 0.0 110.343 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -42.86 91.98 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.713 0.768 . . . . 0.0 109.378 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.69 -37.06 85.42 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.496 0.665 . . . . 0.0 109.821 178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 2.7 tp -65.27 -33.14 75.27 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.292 0.568 . . . . 0.0 110.251 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -37.67 -32.26 0.1 OUTLIER Glycine 0 CA--C 1.536 1.38 0 CA-C-N 116.086 -0.506 . . . . 0.0 112.445 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -73.35 114.91 12.09 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 24.5 ttp-105 . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 117.774 -1.108 . . . . 0.0 110.481 -179.749 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.547 ' C ' HD22 ' B' ' 661' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.547 HD22 ' C ' ' B' ' 660' ' ' LEU . 1.1 mm? 55.61 102.35 0.01 OUTLIER 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.649 0.738 . . . . 0.0 110.392 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.71 176.27 2.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.546 0.689 . . . . 0.0 110.12 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.51 -42.84 61.99 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.465 0.65 . . . . 0.0 110.878 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.67 -36.69 73.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.02 -178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -71.2 -46.44 61.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.102 0.477 . . . . 0.0 110.864 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -67.46 -45.99 74.36 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.298 0.57 . . . . 0.0 110.89 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -20.14 66.14 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 30.8 t -67.88 -35.28 78.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.168 0.509 . . . . 0.0 110.986 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' N ' ' B' ' 669' ' ' LEU . 4.1 mm? -59.86 -29.18 68.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.255 0.55 . . . . 0.0 111.304 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 44.7 m95 -60.3 -27.13 67.06 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 0.0 111.624 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -87.91 -10.3 51.04 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.998 -0.439 . . . . 0.0 112.18 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 10.4 m95 -74.55 -54.24 7.87 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.484 0.659 . . . . 0.0 111.015 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.15 27.77 17.28 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.286 0.565 . . . . 0.0 111.358 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -135.86 -78.69 0.42 Allowed 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.622 -0.673 . . . . 0.0 111.435 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.04 -36.87 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-O 121.64 0.733 . . . . 0.0 110.899 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -51.95 -33.18 36.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.357 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -55.96 -47.71 77.11 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.646 -0.659 . . . . 0.0 109.851 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.593 ' O ' HG23 ' B' ' 682' ' ' ILE . 2.0 t90 -59.64 -38.13 80.56 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.879 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.523 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -58.46 -44.41 89.25 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.344 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -87.73 -42.15 12.82 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -65.76 -25.59 67.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.746 HD12 ' N ' ' B' ' 683' ' ' ARG . 2.5 pp -60.7 -36.64 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.774 -0.579 . . . . 0.0 110.887 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . 0.746 ' N ' HD12 ' B' ' 682' ' ' ILE . 4.3 ttt-85 -56.93 -47.18 81.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.165 0.507 . . . . 0.0 110.655 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.471 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.62 -34.45 65.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.553 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.82 -29.9 68.56 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.117 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.806 HD12 HG21 ' A' ' 686' ' ' ILE . 12.2 mm -60.85 -49.52 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.199 0.524 . . . . 0.0 109.995 -179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.26 -42.49 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 88.9 mt -58.79 -37.95 69.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 685' ' ' PHE . 56.0 t -64.75 -46.82 90.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.08 -27.0 9.58 Favored Glycine 0 CA--C 1.541 1.704 0 O-C-N 121.746 -0.596 . . . . 0.0 112.08 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 39.9 m -60.37 -43.55 96.44 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -177.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.557 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.59 -32.23 70.2 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.513 -0.742 . . . . 0.0 112.361 -177.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.557 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.8 OUTLIER -57.11 -44.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 O-C-N 121.589 -0.694 . . . . 0.0 109.288 -177.631 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.47 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -60.97 -32.74 81.15 Favored Glycine 0 CA--C 1.538 1.518 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 177.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.512 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -57.24 -37.57 72.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.522 0.677 . . . . 0.0 110.908 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 5.8 mmt180 -55.32 -28.93 56.92 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.1 OUTLIER -59.36 -36.22 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 120.798 -1.189 . . . . 0.0 109.076 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.512 HG12 ' O ' ' B' ' 695' ' ' LEU . 0.8 OUTLIER -62.33 -30.36 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 O-C-N 121.691 -0.631 . . . . 0.0 110.157 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 4.3 m-85 -56.2 -30.32 62.12 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 121.737 -0.602 . . . . 0.0 109.5 179.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.4 -37.42 75.28 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 177.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.63 -39.51 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.162 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.03 -36.66 73.04 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.533 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 16.5 m -61.8 -35.38 78.02 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 122.055 -0.403 . . . . 0.0 110.917 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -64.42 -43.76 93.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.23 1.015 . . . . 0.0 108.361 178.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.526 HG22 HD22 ' B' ' 748' ' ' LEU . 53.3 t -64.93 -42.1 93.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.166 178.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.2 m-80 -62.19 -36.58 82.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.22 0.534 . . . . 0.0 110.856 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -68.63 -49.56 58.26 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 122.612 1.196 . . . . 0.0 110.509 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.37 -45.43 29.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -176.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -65.36 -45.94 82.16 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.437 -174.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 758' ' ' ASP . 9.5 pt20 -105.92 -24.83 12.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 132.94 179.81 16.64 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -123.79 -63.84 1.19 Allowed 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.787 -0.831 . . . . 0.0 112.307 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . 0.435 ' HA ' HG21 ' A' ' 708' ' ' VAL . 0.4 OUTLIER -63.78 159.29 54.9 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-O 118.562 -0.732 . . . . 0.0 109.738 179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -29.87 117.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.823 0 C-N-CA 122.813 2.342 . . . . 0.0 112.703 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.71 HD22 ' OD2' ' A' ' 758' ' ' ASP . 1.3 tt -88.75 5.92 41.12 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 122.023 0.916 . . . . 0.0 110.139 179.762 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 122.104 0.954 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -66.03 -26.33 67.47 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.368 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -5.99 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . 0.539 ' HD3' HD21 ' A' ' 774' ' ' LEU . 0.8 OUTLIER -55.08 -33.49 62.8 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.121 -0.987 . . . . 0.0 109.203 179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -69.62 -34.03 73.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -47.75 70.03 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.335 178.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . 0.477 ' O ' HD23 ' B' ' 748' ' ' LEU . 14.5 p -56.87 -34.71 68.1 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.463 HG21 ' CG2' ' A' ' 781' ' ' ILE . 0.3 OUTLIER -52.71 -23.71 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.766 178.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.25 -21.63 59.87 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.526 HD22 HG22 ' B' ' 705' ' ' VAL . 4.0 pp -55.16 -23.52 21.9 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 121.274 0.559 . . . . 0.0 109.543 177.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 7.7 t -55.47 -53.98 30.3 Favored 'Isoleucine or valine' 0 C--N 1.351 0.663 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.451 ' H ' HD22 ' B' ' 750' ' ' ASN . 2.6 m-80 -72.64 -21.5 61.09 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.692 174.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -56.98 -20.6 34.65 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.745 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.6 -42.19 98.51 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 117.936 0.868 . . . . 0.0 109.801 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 15.7 tp -68.39 -47.31 67.67 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.977 0.894 . . . . 0.0 110.278 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -66.95 -34.19 77.22 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.784 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . 0.502 ' C ' HD13 ' B' ' 755' ' ' LEU . 2.5 tm? -58.6 -45.26 89.52 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.918 -0.489 . . . . 0.0 111.815 -176.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . 0.479 HG22 HD12 ' B' ' 760' ' ' LEU . 4.1 mp -72.08 -35.1 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.19 -30.8 69.08 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.66 ' CG ' HD22 ' C' ' 715' ' ' LEU . 10.6 m-20 -55.59 -45.4 77.42 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 120.734 -1.229 . . . . 0.0 109.271 -179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.67 -46.19 63.68 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 111.871 0.322 . . . . 0.0 111.871 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . 0.479 HD12 HG22 ' B' ' 756' ' ' ILE . 44.9 mt -69.77 -46.24 66.24 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -49.97 75.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . 0.418 ' O ' HD13 ' B' ' 774' ' ' LEU . 20.1 p -73.28 -38.33 65.96 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.635 0.731 . . . . 0.0 111.268 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.474 HD23 HD12 ' B' ' 771' ' ' LEU . 0.8 OUTLIER -65.61 -53.11 46.22 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 34.8 p -98.07 -49.13 4.87 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.516 -0.74 . . . . 0.0 112.041 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' B' ' 765' ' ' LEU . 0.3 OUTLIER 77.52 89.0 0.07 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 122.067 0.936 . . . . 0.0 111.337 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 62.62 -74.74 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.823 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 41.0 t -84.64 162.49 19.72 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.527 0.679 . . . . 0.0 111.747 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -23.18 18.01 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.631 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -67.7 -39.82 84.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 122.059 0.933 . . . . 0.0 109.004 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -58.83 -28.94 66.51 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.46 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . 0.474 HD12 HD23 ' B' ' 763' ' ' LEU . 2.6 tt -58.55 -30.72 67.34 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 9.3 mmt-85 -59.89 -32.88 71.15 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.64 -48.66 66.08 Favored 'General case' 0 C--N 1.347 0.496 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.618 HD11 ' CZ ' ' C' ' 742' ' ' ARG . 0.4 OUTLIER -59.18 -37.8 78.27 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.3 1.048 . . . . 0.0 109.662 178.287 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' B' ' 775' ' ' LEU . 0.2 OUTLIER -58.34 -36.37 73.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.445 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 66.1 mt -73.86 -31.71 63.31 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.615 -0.678 . . . . 0.0 112.236 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . 0.443 HD11 HH22 ' C' ' 742' ' ' ARG . 8.3 pt -70.35 -37.29 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.541 -0.725 . . . . 0.0 111.305 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.403 HG22 ' O ' ' B' ' 775' ' ' LEU . 35.5 m -66.08 -40.21 86.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.271 -0.893 . . . . 0.0 110.936 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 2.4 t -63.68 -47.41 81.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.803 -0.561 . . . . 0.0 112.081 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.7 82.1 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.699 -0.626 . . . . 0.0 111.695 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.418 HD12 ' O ' ' B' ' 777' ' ' ILE . 65.5 mt -63.97 -43.59 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 O-C-N 122.088 -0.383 . . . . 0.0 111.32 -178.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.575 HG11 HG11 ' C' ' 749' ' ' VAL . 18.8 m -59.48 -38.24 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.48 -0.762 . . . . 0.0 109.8 179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.32 -42.9 99.43 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.599 0.714 . . . . 0.0 109.674 179.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.62 -42.43 95.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.332 0.586 . . . . 0.0 110.832 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' C' ' 747' ' ' ARG . 10.9 tp -82.15 -14.58 55.47 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.041 0.448 . . . . 0.0 111.924 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -53.52 -44.2 67.45 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -75.32 141.67 43.35 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 122.296 -0.532 . . . . 0.0 109.977 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.851 -179.78 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.593 HD13 ' N ' ' C' ' 660' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 120.528 0.204 . . . . 0.0 110.798 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 18.4 mt 59.96 120.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.668 0.747 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -173.2 172.18 3.91 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.721 0.772 . . . . 0.0 110.857 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.7 OUTLIER -57.53 -51.39 69.64 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 122.079 0.942 . . . . 0.0 109.448 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.54 ' N ' HD13 ' C' ' 663' ' ' LEU . 12.7 t70 -72.66 -16.64 61.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.759 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 4.3 tmtt? -81.08 -46.36 15.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.262 0.553 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -62.18 -46.34 89.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.241 0.543 . . . . 0.0 110.878 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.39 -22.09 66.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.982 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.7 -32.92 73.07 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.975 -0.453 . . . . 0.0 111.434 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.3 -34.16 77.5 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.194 0.521 . . . . 0.0 111.864 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -59.86 -26.77 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.983 0.421 . . . . 0.0 111.043 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -77.14 -31.75 55.85 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.942 0.401 . . . . 0.0 111.604 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.4 m0 -55.24 -42.65 73.71 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.542 0.687 . . . . 0.0 110.357 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 7.4 t80 55.49 34.58 23.34 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.218 0.532 . . . . 0.0 111.484 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -148.83 -73.7 0.18 Allowed 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.65 -0.656 . . . . 0.0 112.032 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.669 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -37.15 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.489 0.661 . . . . 0.0 111.599 -178.708 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -51.63 -33.54 33.8 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.91 -0.494 . . . . 0.0 111.383 -178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -57.29 -49.36 76.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.625 0.726 . . . . 0.0 109.64 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.521 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.4 t90 -64.56 -42.15 95.86 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.087 0.47 . . . . 0.0 110.062 179.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 32.2 mt -66.15 -35.64 81.01 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -99.56 -19.58 16.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -176.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -88.15 -18.17 29.35 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.428 -0.795 . . . . 0.0 112.281 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.522 ' HA ' ' HB2' ' C' ' 685' ' ' PHE . 8.0 pt -63.16 -37.58 79.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 O-C-N 121.945 -0.472 . . . . 0.0 111.786 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -57.18 -47.41 81.3 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.294 0.568 . . . . 0.0 110.044 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.494 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.0 mp -65.96 -32.17 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' C' ' 682' ' ' ILE . 0.4 OUTLIER -61.13 -32.43 72.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.722 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.941 HG21 HD12 ' A' ' 686' ' ' ILE . 13.3 mm -61.97 -48.75 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 121.171 0.51 . . . . 0.0 110.158 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.96 -41.1 91.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 90.3 mt -59.91 -37.56 72.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.469 HG23 ' O ' ' C' ' 685' ' ' PHE . 42.6 t -54.7 -41.66 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -54.42 -42.07 74.0 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 7.3 m -65.91 -38.23 88.16 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.812 0.815 . . . . 0.0 109.302 177.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.37 -45.99 89.9 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.097 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.674 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -68.1 -41.09 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.662 179.804 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.541 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.67 -32.48 78.83 Favored Glycine 0 CA--C 1.54 1.619 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.588 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.7 tt -55.0 -37.34 66.47 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.816 0.817 . . . . 0.0 110.742 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -55.49 -28.37 54.19 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.541 HG22 ' O ' ' C' ' 694' ' ' GLY . 18.4 tt -58.36 -35.72 55.14 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 O-C-N 121.267 -0.896 . . . . 0.0 111.603 -175.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.588 HG12 ' O ' ' C' ' 695' ' ' LEU . 12.8 p -54.26 -30.32 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 O-C-N 121.411 -0.806 . . . . 0.0 109.852 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -57.0 -31.83 65.49 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.525 -0.734 . . . . 0.0 110.52 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.22 95.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.243 1.021 . . . . 0.0 108.603 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.2 -38.74 78.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.969 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.926 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 tp -65.7 -40.04 91.88 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.183 0.593 . . . . 0.0 110.393 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 1.4 p -62.93 -31.99 73.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.044 0.45 . . . . 0.0 110.27 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.439 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.5 OUTLIER -63.22 -46.8 85.27 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 122.412 1.101 . . . . 0.0 108.428 177.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.514 HG13 HD13 ' C' ' 748' ' ' LEU . 84.6 t -63.12 -45.95 97.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.495 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -63.37 -36.58 84.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.128 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 15.2 ttp85 -60.24 -50.04 75.24 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 121.482 -0.761 . . . . 0.0 111.37 -176.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.522 HG12 HD11 ' C' ' 748' ' ' LEU . 0.5 OUTLIER -77.67 -43.08 29.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -178.183 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.84 -44.73 92.31 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -175.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . 0.455 ' HB2' ' HB3' ' B' ' 758' ' ' ASP . 6.5 pt20 -103.92 -23.9 13.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 118.31 -177.3 16.44 Favored Glycine 0 CA--C 1.538 1.477 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -138.73 -43.66 0.48 Allowed 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.534 -0.98 . . . . 0.0 112.229 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.407 ' O ' ' C ' ' C' ' 714' ' ' PRO . 82.6 p -62.71 147.6 92.82 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 117.704 -1.141 . . . . 0.0 107.924 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . 0.407 ' C ' ' O ' ' C' ' 713' ' ' SER . 44.8 Cg_exo -28.44 94.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.505 2.172 0 C-N-CA 122.962 2.442 . . . . 0.0 112.212 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.66 HD22 ' CG ' ' B' ' 758' ' ' ASP . 5.3 mp -69.84 -9.71 55.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.204 -1.362 . . . . 0.0 114.466 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 122.29 1.043 . . . . 0.0 112.386 -178.847 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 122.133 0.968 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 24.7 tpt85 -59.38 -26.99 65.58 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.898 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -34.51 70.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 0.0 111.955 -178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.618 ' CZ ' HD11 ' B' ' 774' ' ' LEU . 32.8 mtm105 -67.57 -27.84 67.28 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.97 -37.54 74.4 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 121.736 -0.603 . . . . 0.0 109.647 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -71.47 -43.2 67.04 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 121.502 0.668 . . . . 0.0 109.615 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 55.2 p -58.74 -38.12 77.7 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 121.895 -0.503 . . . . 0.0 110.914 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . . . . . . . . . 1.5 mp -56.75 -20.0 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . 0.417 ' HA ' HD22 ' B' ' 785' ' ' LEU . 70.8 mtp180 -59.57 -25.07 64.26 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.589 -0.694 . . . . 0.0 109.494 179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.522 HD11 HG12 ' C' ' 708' ' ' VAL . 7.7 mt -55.92 -28.8 58.48 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 122.254 -0.279 . . . . 0.0 111.512 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . 0.575 HG11 HG11 ' B' ' 782' ' ' VAL . 85.2 t -55.43 -54.87 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.436 HD22 ' H ' ' C' ' 750' ' ' ASN . 2.5 m-80 -73.08 -26.91 61.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.331 1.062 . . . . 0.0 109.074 174.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.29 -20.9 38.15 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.054 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 47.8 m -58.74 -37.85 77.09 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.834 0.817 . . . . 0.0 109.379 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.53 -51.18 38.05 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.721 0.772 . . . . 0.0 109.994 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . 0.692 ' HB1' ' HA ' ' A' ' 716' ' ' SER . . . -63.31 -34.58 78.0 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.414 HD23 ' O ' ' C' ' 755' ' ' LEU . 5.0 tt -58.77 -45.45 89.77 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.768 -0.583 . . . . 0.0 110.785 -177.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 41.8 mm -69.88 -33.35 55.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 110.278 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.38 -31.14 69.35 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -55.81 -47.01 77.9 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.064 -1.022 . . . . 0.0 109.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.29 -45.36 66.47 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.991 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 27.3 mt -66.35 -45.45 80.15 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -66.43 -48.78 68.93 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.865 -0.522 . . . . 0.0 112.102 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 6.1 t -64.94 -45.29 86.4 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 110.759 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.449 ' O ' ' HG ' ' C' ' 774' ' ' LEU . 1.0 OUTLIER -68.34 -54.54 16.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.843 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.89 -47.48 5.54 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.124 -0.985 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' C' ' 766' ' ' PHE . 1.6 tt 72.84 129.91 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -178.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' C' ' 765' ' ' LEU . 32.9 t80 -9.05 123.53 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.902 1.281 . . . . 0.0 114.359 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . 0.435 ' O ' ' C ' ' C' ' 768' ' ' TYR . 1.3 m 48.94 91.26 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.57 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' C' ' 770' ' ' ARG . 41.3 m-85 3.87 -97.86 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.691 1.197 . . . . 0.0 113.609 -179.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 39.59 -76.96 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.925 0.784 . . . . 0.0 113.103 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . 0.575 ' N ' ' O ' ' C' ' 768' ' ' TYR . 32.1 mmt180 -55.3 -29.01 57.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.465 0.706 . . . . 0.0 110.528 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.22 -38.15 79.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.671 -0.643 . . . . 0.0 109.452 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -38.82 72.94 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -69.32 -34.51 74.78 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.978 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.529 HD13 ' O ' ' C' ' 774' ' ' LEU . 3.5 tm? -58.4 -42.61 87.52 Favored 'General case' 0 C--N 1.355 0.813 0 O-C-N 121.759 -0.588 . . . . 0.0 109.606 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . . . . . . . . . 8.3 mp -58.63 -43.05 89.57 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.921 -0.487 . . . . 0.0 111.181 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 9.9 mt -73.0 -33.24 65.65 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.107 0.479 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.542 ' O ' HG12 ' C' ' 781' ' ' ILE . 0.1 OUTLIER -62.35 -37.84 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.7 -42.72 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 122.151 -0.343 . . . . 0.0 110.9 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.772 ' O ' HG22 ' C' ' 782' ' ' VAL . 1.6 p -63.36 -42.12 98.88 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.229 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -31.71 71.94 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 122.051 -0.405 . . . . 0.0 111.861 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.593 HD12 ' HB3' ' A' ' 743' ' ' ASP . 21.3 mm -56.23 -39.73 61.39 Favored 'Isoleucine or valine' 0 C--N 1.347 0.486 0 O-C-N 121.762 -0.586 . . . . 0.0 111.346 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.772 HG22 ' O ' ' C' ' 779' ' ' THR . 21.6 m -52.73 -37.44 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.464 -177.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -55.05 -41.65 71.71 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . 0.509 ' O ' HD12 ' C' ' 784' ' ' LEU . 2.2 tp -63.66 -45.03 92.01 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -176.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.55 HD22 ' HB3' ' A' ' 747' ' ' ARG . 0.6 OUTLIER -78.48 -31.99 48.1 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.577 0.703 . . . . 0.0 109.302 179.765 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -45.71 -38.24 7.46 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.756 -0.937 . . . . 0.0 110.756 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -95.95 139.14 32.58 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.457 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.684 ' N ' HD23 ' C' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 120.762 0.315 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 175.32 129.78 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -171.65 177.81 3.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.923 0.868 . . . . 0.0 111.117 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.488 HD23 ' N ' ' A' ' 664' ' ' ASP . 5.1 tt -51.57 -51.1 58.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.721 0.772 . . . . 0.0 110.544 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . 0.488 ' N ' HD23 ' A' ' 663' ' ' LEU . 1.3 t70 -64.9 -30.51 71.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.864 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -48.15 37.22 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.406 0.622 . . . . 0.0 110.815 -179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -62.81 -46.08 89.62 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.674 0.75 . . . . 0.0 110.33 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.77 -20.2 65.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.718 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 24.7 t -71.38 -32.07 68.04 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.156 0.503 . . . . 0.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.99 -34.62 73.57 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.897 0.379 . . . . 0.0 111.061 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -59.69 -16.44 26.75 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.842 -0.536 . . . . 0.0 111.313 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -82.63 -26.16 32.48 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.361 0.6 . . . . 0.0 110.732 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -60.31 -42.07 94.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.537 0.684 . . . . 0.0 110.299 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 22.5 t80 60.56 35.09 20.16 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.543 0.687 . . . . 0.0 111.267 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -156.09 -66.92 0.11 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.619 -0.675 . . . . 0.0 111.652 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 6.3 tp -65.55 -37.37 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 O-C-N 121.891 -0.506 . . . . 0.0 111.342 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.9 m -52.48 -34.3 48.55 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.898 -0.501 . . . . 0.0 111.986 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -63.4 -50.53 69.47 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.326 0.584 . . . . 0.0 110.261 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.581 ' O ' HG23 ' A' ' 682' ' ' ILE . 3.5 t90 -66.01 -44.12 85.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 122.167 0.984 . . . . 0.0 109.53 178.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -35.77 77.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.949 -177.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -101.25 -50.53 3.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -59.9 -10.35 3.93 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.545 -0.722 . . . . 0.0 112.645 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.766 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.0 pp -60.71 -36.33 70.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 121.657 -0.652 . . . . 0.0 110.368 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.766 ' N ' HD12 ' A' ' 682' ' ' ILE . 11.9 ttt-85 -54.63 -47.27 73.68 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.998 0.427 . . . . 0.0 110.403 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.9 mp -69.38 -35.99 69.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.454 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.3 OUTLIER -59.96 -30.51 69.15 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.122 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.99 HD12 HG21 ' C' ' 686' ' ' ILE . 12.3 mm -60.58 -50.04 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.374 0.607 . . . . 0.0 109.629 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 79.2 mt -60.84 -39.02 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -60.1 -36.97 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.049 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.7 t -54.17 -40.04 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.237 -0.914 . . . . 0.0 108.554 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.43 -39.2 92.59 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -64.72 -38.21 90.22 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.666 0.746 . . . . 0.0 109.587 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -46.18 89.05 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.502 -178.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -40.29 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.257 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -60.63 -28.42 67.8 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 2.3 tt -61.98 -37.54 85.16 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.488 1.137 . . . . 0.0 109.035 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 29.7 mmt180 -55.73 -27.64 51.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.054 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 mm -58.19 -36.29 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 121.108 -0.995 . . . . 0.0 108.681 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.759 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.4 p -61.95 -30.29 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 O-C-N 121.534 -0.729 . . . . 0.0 110.572 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 6.4 m-85 -55.38 -29.07 57.76 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.865 -0.522 . . . . 0.0 110.54 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.14 -36.97 71.34 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.759 HG22 ' O ' ' A' ' 698' ' ' VAL . 3.7 m -59.36 -36.2 62.62 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 CA-C-O 121.727 0.775 . . . . 0.0 108.967 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tp -60.89 -38.92 87.34 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.823 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 54.7 m -63.07 -38.86 92.89 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.762 0.792 . . . . 0.0 109.695 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.632 HD11 ' O ' ' B' ' 712' ' ' TYR . 0.5 OUTLIER -61.4 -40.87 95.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 122.179 0.99 . . . . 0.0 109.312 178.107 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.798 HG22 HD12 ' A' ' 748' ' ' LEU . 95.8 t -68.56 -43.59 83.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.065 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -62.31 -41.79 98.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.409 ' HA ' HD21 ' C' ' 704' ' ' LEU . 15.1 ptp180 -66.05 -38.74 89.11 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 121.012 -1.055 . . . . 0.0 111.498 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -76.35 -43.96 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.955 0.883 . . . . 0.0 108.893 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -73.77 -15.73 61.19 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -87.97 -20.87 25.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.279 -0.888 . . . . 0.0 111.992 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 107.94 37.99 2.09 Favored Glycine 0 CA--C 1.54 1.638 0 O-C-N 121.6 -0.687 . . . . 0.0 113.094 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.412 ' CZ ' ' NH1' ' C' ' 707' ' ' ARG . 0.6 OUTLIER 49.17 -133.49 1.5 Allowed 'General case' 0 CA--C 1.566 1.576 0 O-C-N 121.616 -0.932 . . . . 0.0 110.077 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.569 ' HA ' HG21 ' C' ' 708' ' ' VAL . 6.7 p -62.92 159.9 42.17 Favored Pre-proline 0 C--N 1.354 0.784 0 O-C-N 120.925 -1.11 . . . . 0.0 109.138 178.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . 0.421 ' HG3' HD12 ' C' ' 748' ' ' LEU . 35.7 Cg_exo -36.81 119.76 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.144 1.896 . . . . 0.0 112.877 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.449 HD23 ' N ' ' A' ' 716' ' ' SER . 0.1 OUTLIER -109.35 -20.54 12.89 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.449 ' N ' HD23 ' A' ' 715' ' ' LEU . 1.4 t . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 122.482 1.134 . . . . 0.0 110.589 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 CA--C 1.536 0.437 0 CA-C-O 121.698 0.761 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -58.04 -26.56 62.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.385 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.27 -37.01 74.13 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.695 -0.628 . . . . 0.0 112.133 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . 0.506 ' HD3' ' HB2' ' C' ' 762' ' ' SER . 0.1 OUTLIER -59.2 -46.39 88.54 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.777 -0.577 . . . . 0.0 112.363 -179.051 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . 0.791 ' HA ' HD11 ' C' ' 781' ' ' ILE . 1.4 p30 -59.46 -44.77 92.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.577 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . 0.599 ' HD3' HD12 ' C' ' 785' ' ' LEU . 0.0 OUTLIER -71.15 -34.84 71.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.931 179.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 9.2 p -59.82 -42.52 93.68 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 122.113 -0.367 . . . . 0.0 111.438 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.878 HG22 HG21 ' C' ' 781' ' ' ILE . 21.9 mt -65.63 -46.64 88.83 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-O 116.771 -1.585 . . . . 0.0 113.66 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.876 ' HB3' ' HB3' ' C' ' 785' ' ' LEU . 0.1 OUTLIER -67.59 -5.0 13.42 Favored 'General case' 0 C--N 1.351 0.663 0 CA-C-N 122.204 2.275 . . . . 0.0 109.989 -178.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.798 HD12 HG22 ' A' ' 705' ' ' VAL . 2.8 tm? -54.9 -15.13 1.76 Allowed 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.542 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.304 1.3 t -53.1 -53.95 19.77 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 175.087 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.582 HD22 ' H ' ' A' ' 750' ' ' ASN . 1.2 m-80 -72.39 -30.22 64.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 113.999 -1.455 . . . . 0.0 107.727 174.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.499 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.71 -19.21 27.36 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 96.0 p -57.28 -36.87 71.57 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.3 -49.21 77.93 Favored 'General case' 0 C--N 1.346 0.457 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 176.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -59.79 -35.0 73.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.735 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . . . . . . . . . 8.2 tt -59.21 -42.58 91.28 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.857 -0.527 . . . . 0.0 111.239 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 66.1 mt -61.61 -35.68 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -68.96 -30.61 69.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.199 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.511 ' HB3' HD13 ' B' ' 715' ' ' LEU . 7.1 m-20 -55.7 -49.22 73.59 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.566 -0.709 . . . . 0.0 109.58 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.75 -43.73 68.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.873 0.844 . . . . 0.0 110.388 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . 0.4 ' HA ' HD11 ' A' ' 763' ' ' LEU . 0.3 OUTLIER -59.74 -32.39 70.51 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.924 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -82.27 -31.14 30.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -177.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 35.8 t -66.46 -46.61 75.81 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.397 -0.814 . . . . 0.0 112.766 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 771' ' ' LEU . 0.0 OUTLIER -69.37 -55.05 11.52 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 121.661 -0.649 . . . . 0.0 112.406 -179.589 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 4.5 p -98.26 -49.13 4.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.685 0.755 . . . . 0.0 112.959 -177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.483 HD12 ' HG2' ' B' ' 739' ' ' GLU . 0.6 OUTLIER 83.76 -70.26 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.663 0.785 . . . . 0.0 110.636 -177.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -128.72 -58.25 1.17 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.792 -0.568 . . . . 0.0 111.051 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 5.4 m -92.2 132.15 36.87 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.081 0.467 . . . . 0.0 110.126 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . 0.528 ' CZ ' HD22 ' A' ' 771' ' ' LEU . 1.7 t80 -61.77 -13.0 19.67 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 122.121 -0.362 . . . . 0.0 111.413 -179.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -37.56 87.99 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 121.926 0.87 . . . . 0.0 108.995 178.032 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -29.27 59.21 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.578 178.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' ' 763' ' ' LEU . 24.4 tp -58.97 -39.44 81.73 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 41.5 mtp180 -66.93 -32.96 74.56 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.54 -45.68 74.99 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.679 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' HG23 ' A' ' 778' ' ' VAL . 5.7 tp -58.97 -42.29 89.58 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.065 -0.654 . . . . 0.0 111.136 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 775' ' ' LEU . 1.1 tt -63.38 -38.53 91.51 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.689 -0.632 . . . . 0.0 111.005 -177.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.75 -43.96 57.57 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 121.944 -0.473 . . . . 0.0 112.013 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . 0.415 HD12 ' N ' ' A' ' 778' ' ' VAL . 2.6 pp -68.68 -37.45 77.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.048 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 774' ' ' LEU . 41.1 t -56.29 -46.17 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 O-C-N 121.791 -0.568 . . . . 0.0 109.706 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . 0.738 ' O ' HG22 ' A' ' 782' ' ' VAL . 68.8 p -63.52 -46.01 88.01 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.835 -0.541 . . . . 0.0 112.067 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -31.79 72.37 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.471 ' HB ' HG21 ' B' ' 746' ' ' ILE . 56.4 mt -54.77 -36.41 36.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.583 -0.698 . . . . 0.0 110.55 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 779' ' ' THR . 13.1 m -54.2 -38.39 38.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 121.23 -0.919 . . . . 0.0 109.753 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.34 -49.22 78.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.626 0.726 . . . . 0.0 110.774 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 31.3 tp -70.01 -42.48 72.94 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.264 0.554 . . . . 0.0 111.92 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.538 HD22 ' ND2' ' B' ' 750' ' ' ASN . 0.2 OUTLIER -75.32 -17.95 60.13 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.021 0.439 . . . . 0.0 111.703 -179.199 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.09 -41.76 11.45 Favored Glycine 0 CA--C 1.533 1.162 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -110.13 151.87 26.72 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 122.062 -0.669 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 8.8 tpp85 . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 118.1 -0.952 . . . . 0.0 110.327 -179.599 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.452 ' C ' HD22 ' B' ' 661' ' ' LEU . 4.0 mp . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.57 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.0 mm? 61.77 115.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.524 0.678 . . . . 0.0 110.327 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -179.72 170.99 1.23 Allowed 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.467 HD11 ' HB2' ' C' ' 660' ' ' LEU . 32.8 tp -64.22 -40.75 96.7 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 121.473 0.654 . . . . 0.0 110.498 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.13 -24.15 67.76 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.379 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -81.26 -43.21 19.53 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -62.02 -46.79 87.64 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 122.006 0.908 . . . . 0.0 110.607 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.22 65.45 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.618 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 7.1 t -72.31 -29.22 63.65 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.819 0.342 . . . . 0.0 111.389 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.562 HD12 HG23 ' B' ' 675' ' ' ILE . 3.8 mm? -59.91 -32.73 71.03 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 122.185 -0.322 . . . . 0.0 111.179 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -59.66 -20.38 55.76 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.769 -0.582 . . . . 0.0 111.197 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -88.0 -20.41 25.87 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.169 0.509 . . . . 0.0 111.341 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -72.55 -46.7 53.18 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.099 0.476 . . . . 0.0 111.127 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 67.7 t80 58.66 19.86 7.19 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.379 0.609 . . . . 0.0 111.314 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -130.53 -67.72 0.72 Allowed 'General case' 0 CA--C 1.539 0.527 0 O-C-N 121.378 -0.826 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.562 HG23 HD12 ' B' ' 669' ' ' LEU . 6.4 tp -68.27 -37.11 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-O 120.891 0.377 . . . . 0.0 110.92 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.15 -33.92 42.42 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.232 -0.293 . . . . 0.0 111.775 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -63.79 -50.35 69.35 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 109.883 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.652 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.1 t90 -65.97 -43.08 88.94 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 121.751 0.786 . . . . 0.0 109.754 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -35.75 82.1 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 8.9 t90 -103.93 -26.68 12.56 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -82.24 -10.48 59.11 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.513 -0.742 . . . . 0.0 111.761 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.652 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -60.85 -36.33 70.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.824 -0.548 . . . . 0.0 110.793 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.5 ttt-85 -53.32 -47.39 69.33 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.925 0.393 . . . . 0.0 110.4 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.461 ' N ' HD12 ' B' ' 684' ' ' ILE . 1.9 mp -66.7 -35.58 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.528 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -60.03 -29.46 68.52 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.18 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.696 HD12 HG21 ' A' ' 686' ' ' ILE . 17.6 mm -60.79 -48.28 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.211 0.529 . . . . 0.0 110.277 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.44 -43.17 94.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 89.4 mt -58.85 -37.71 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.528 HG23 ' O ' ' B' ' 685' ' ' PHE . 46.6 t -62.2 -48.77 86.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.5 -27.1 11.12 Favored Glycine 0 CA--C 1.54 1.613 0 O-C-N 121.772 -0.58 . . . . 0.0 111.896 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.0 m -60.61 -39.68 89.07 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.494 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.62 -32.7 70.66 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.235 -0.916 . . . . 0.0 111.643 -177.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.494 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.87 -46.96 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.45 -27.39 67.78 Favored Glycine 0 CA--C 1.542 1.737 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 178.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.45 -37.16 67.37 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.758 0.789 . . . . 0.0 110.458 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' B' ' 699' ' ' PHE . 15.9 mmt180 -55.18 -27.99 49.78 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -178.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.726 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.29 -36.44 58.1 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 O-C-N 120.792 -1.193 . . . . 0.0 109.465 -177.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 2.0 p -66.99 -30.25 48.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.477 -0.764 . . . . 0.0 110.169 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 10.6 m-85 -55.88 -30.58 61.77 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.648 -0.657 . . . . 0.0 109.652 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.57 76.19 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.38 -41.98 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 176.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.08 -37.87 72.51 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.445 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 29.2 m -62.83 -37.0 85.04 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.289 0.566 . . . . 0.0 110.38 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -45.26 93.29 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 122.322 1.058 . . . . 0.0 109.137 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.8 -43.34 89.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.995 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 1.3 m-80 -62.36 -36.42 82.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.568 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -63.58 -49.56 72.91 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 122.404 1.097 . . . . 0.0 110.764 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.664 HG11 HD21 ' B' ' 748' ' ' LEU . 1.5 t -77.16 -44.9 30.81 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 114.79 -1.095 . . . . 0.0 113.645 -177.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.25 -45.94 92.43 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.639 ' O ' HD12 ' B' ' 715' ' ' LEU . 5.1 pt20 -105.77 -24.69 12.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.415 1.102 . . . . 0.0 113.644 178.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 129.63 136.34 4.05 Favored Glycine 0 CA--C 1.537 1.434 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . 0.632 ' O ' HD11 ' A' ' 704' ' ' LEU . 2.8 p90 -73.71 -61.77 1.72 Allowed 'General case' 0 N--CA 1.477 0.913 0 O-C-N 122.002 -0.705 . . . . 0.0 112.072 -178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . . . . . . . . . 54.9 p -66.35 159.36 73.0 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.632 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.51 ' HB3' HD23 ' A' ' 748' ' ' LEU . 41.7 Cg_exo -32.5 131.78 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.31 2.007 . . . . 0.0 112.825 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.639 HD12 ' O ' ' B' ' 710' ' ' GLN . 7.6 tt -93.74 -20.42 20.15 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -176.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 715' ' ' LEU . 2.8 t . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 122.17 0.986 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . 0.483 ' HG2' HD12 ' A' ' 765' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 18.4 tpt85 -65.94 -26.98 67.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.575 0.703 . . . . 0.0 111.275 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -60.83 -6.7 1.9 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -55.73 -39.63 71.39 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.517 -0.739 . . . . 0.0 111.195 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -58.02 -39.69 78.97 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.655 -0.653 . . . . 0.0 109.74 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -68.01 -38.85 83.08 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . 0.458 ' O ' HD23 ' B' ' 748' ' ' LEU . 1.3 p -59.7 -44.68 93.57 Favored 'General case' 0 N--CA 1.462 0.175 0 O-C-N 121.963 -0.461 . . . . 0.0 110.564 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.51 HD11 HG22 ' A' ' 778' ' ' VAL . 1.2 mp -55.17 -19.45 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.418 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.513 ' HG3' HD11 ' A' ' 785' ' ' LEU . 1.3 ttt85 -59.89 -26.63 66.04 Favored 'General case' 0 C--N 1.346 0.428 0 O-C-N 121.594 -0.691 . . . . 0.0 109.437 178.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.664 HD21 HG11 ' B' ' 708' ' ' VAL . 3.2 mm? -55.49 -20.4 12.7 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . 0.414 HG23 ' O ' ' B' ' 746' ' ' ILE . 65.2 t -57.43 -54.22 33.84 Favored 'Isoleucine or valine' 0 C--N 1.352 0.697 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 176.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.538 ' ND2' HD22 ' A' ' 785' ' ' LEU . 4.4 m-80 -72.94 -18.0 61.43 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.211 174.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.06 -20.68 35.56 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.915 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 23.1 p -58.76 -38.05 77.6 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.031 0.916 . . . . 0.0 109.685 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.91 -49.98 58.83 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.243 0.544 . . . . 0.0 110.029 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.52 78.61 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.98 -45.53 88.64 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.582 -0.699 . . . . 0.0 111.604 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 55.9 mt -67.01 -38.59 81.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 121.835 0.826 . . . . 0.0 109.484 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.01 67.96 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.587 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -55.15 -49.35 72.03 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 120.734 -1.229 . . . . 0.0 110.05 -178.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.25 -46.36 61.18 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 112.638 0.606 . . . . 0.0 112.638 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.18 -46.83 63.81 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -63.85 -37.82 88.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.37 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 84.5 p -70.44 -45.17 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.52 0.676 . . . . 0.0 110.957 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.678 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.7 OUTLIER -61.92 -53.7 52.13 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.926 0.714 . . . . 0.0 112.926 -178.517 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 6.6 p -98.5 -11.82 21.89 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -177.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.41 -154.62 0.34 Allowed 'General case' 0 CA--C 1.552 1.023 0 O-C-N 121.206 -0.934 . . . . 0.0 108.54 -177.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -48.93 -72.61 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.36 -0.837 . . . . 0.0 111.529 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 87.6 p -80.34 177.2 9.13 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.707 -0.621 . . . . 0.0 111.334 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.42 -31.98 13.13 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.978 -0.451 . . . . 0.0 110.722 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -53.89 -35.18 61.32 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.522 0.677 . . . . 0.0 109.854 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -29.57 60.33 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.66 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -59.44 -35.45 74.04 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 121.934 -0.479 . . . . 0.0 110.103 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -39.24 90.63 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -69.18 -45.18 70.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.337 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.678 HD13 ' O ' ' B' ' 763' ' ' LEU . 1.0 OUTLIER -63.05 -37.9 89.04 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.958 0.885 . . . . 0.0 110.564 179.721 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.537 HD13 ' O ' ' B' ' 775' ' ' LEU . 3.5 tm? -58.75 -36.66 74.72 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.381 0.61 . . . . 0.0 110.539 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.27 -35.61 73.86 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.59 -0.694 . . . . 0.0 112.152 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . . . . . . . . . 21.7 pt -70.29 -37.09 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 O-C-N 121.688 -0.632 . . . . 0.0 111.325 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.513 HG12 HG12 ' C' ' 746' ' ' ILE . 3.4 m -61.9 -39.48 83.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 121.132 -0.98 . . . . 0.0 109.857 -179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . . . . . . . . . 20.4 p -63.69 -47.32 81.66 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.929 -0.482 . . . . 0.0 112.2 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -33.25 74.15 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.405 -0.809 . . . . 0.0 111.269 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . . . . . . . . . 71.0 mt -66.12 -44.57 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.8 -0.563 . . . . 0.0 111.834 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.603 HG11 HG11 ' C' ' 749' ' ' VAL . 24.8 m -59.3 -38.1 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.471 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -57.41 -44.25 84.43 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.798 0.809 . . . . 0.0 109.82 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 25.6 tp -69.98 -43.46 71.44 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.871 -179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' C' ' 750' ' ' ASN . 8.2 tp -65.03 -25.23 67.75 Favored 'General case' 0 N--CA 1.466 0.37 0 O-C-N 121.964 -0.46 . . . . 0.0 111.15 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -36.17 -47.96 1.1 Allowed Glycine 0 CA--C 1.536 1.363 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.75 97.44 8.08 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.686 -179.076 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.5 ' O ' HD12 ' C' ' 660' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 121.576 0.703 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.32 160.28 15.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.093 0.473 . . . . 0.0 110.818 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 172.81 175.56 0.1 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.29 0.567 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.699 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -58.07 -45.95 86.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.85 0.834 . . . . 0.0 109.622 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.654 ' N ' HD13 ' C' ' 663' ' ' LEU . 10.0 t70 -73.3 -22.7 60.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.149 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -46.51 14.58 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.1 0.476 . . . . 0.0 111.145 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -58.8 -46.15 88.26 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.406 0.622 . . . . 0.0 109.602 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.75 -21.04 65.29 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.971 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.1 t -64.86 -35.12 80.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.987 0.423 . . . . 0.0 111.523 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.68 -36.28 76.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.132 0.491 . . . . 0.0 110.98 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -59.55 -22.15 61.29 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.3 0.571 . . . . 0.0 110.768 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -75.93 -29.26 58.29 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.457 0.646 . . . . 0.0 110.736 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -61.52 -41.66 97.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.749 0.785 . . . . 0.0 109.892 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 5.7 t80 58.87 36.03 24.46 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.027 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -160.98 -68.08 0.06 Allowed 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.571 -0.706 . . . . 0.0 112.291 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.635 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.3 OUTLIER -62.91 -37.22 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-O 121.472 0.653 . . . . 0.0 111.415 -178.689 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 3.9 m -52.41 -33.67 44.81 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 122.014 -0.429 . . . . 0.0 111.444 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -56.83 -49.25 75.98 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.63 0.729 . . . . 0.0 109.745 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.559 ' O ' HG23 ' C' ' 682' ' ' ILE . 1.2 t90 -65.14 -40.62 94.67 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.908 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.69 -35.89 82.07 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -92.86 -48.39 6.57 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -60.34 -21.16 61.74 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.902 -0.499 . . . . 0.0 112.086 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.773 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.1 pp -60.48 -36.5 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 O-C-N 121.713 -0.617 . . . . 0.0 110.547 179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.773 ' N ' HD12 ' C' ' 682' ' ' ILE . 12.4 ttt-85 -57.65 -47.14 83.09 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.244 0.545 . . . . 0.0 110.257 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.471 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.9 mp -70.95 -33.25 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 121.67 0.747 . . . . 0.0 109.067 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.452 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.62 -33.99 72.19 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.037 -179.309 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.99 HG21 HD12 ' A' ' 686' ' ' ILE . 13.0 mm -60.65 -43.48 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.45 0.643 . . . . 0.0 109.498 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 56.1 mt -66.01 -41.65 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.25 -38.0 72.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.452 HG23 ' O ' ' C' ' 685' ' ' PHE . 69.3 t -54.99 -40.42 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.08 -37.82 87.27 Favored Glycine 0 CA--C 1.531 1.058 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -67.29 -37.72 83.86 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.063 0.935 . . . . 0.0 109.465 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 tp -59.24 -44.55 92.35 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.024 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -62.68 -42.05 94.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 121.242 0.544 . . . . 0.0 109.778 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.62 -33.08 80.65 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 178.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.507 ' O ' HG12 ' C' ' 698' ' ' VAL . 1.8 tt -60.82 -37.93 83.68 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.971 0.891 . . . . 0.0 109.839 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -56.09 -28.3 57.14 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.6 tt -58.44 -36.02 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.258 -0.901 . . . . 0.0 111.206 -175.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.507 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.5 p -54.43 -30.18 21.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 121.425 -0.797 . . . . 0.0 110.219 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -56.39 -31.3 63.72 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.822 -0.549 . . . . 0.0 110.293 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.65 82.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 1.2 t -68.72 -42.52 83.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.82 -38.14 84.4 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.496 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.0 m -66.76 -37.12 83.99 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.424 0.631 . . . . 0.0 110.088 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 707' ' ' ARG . 0.2 OUTLIER -63.73 -42.32 97.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.954 0.883 . . . . 0.0 108.821 178.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.659 HG13 HD21 ' C' ' 748' ' ' LEU . 41.0 t -65.08 -45.54 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 122.546 1.165 . . . . 0.0 108.716 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.85 -35.89 81.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.015 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.412 ' NH1' ' CZ ' ' A' ' 712' ' ' TYR . 0.0 OUTLIER -62.56 -49.58 74.72 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 121.685 -0.635 . . . . 0.0 111.336 -177.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.569 HG21 ' HA ' ' A' ' 713' ' ' SER . 3.0 p -77.47 -44.41 29.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.527 0.68 . . . . 0.0 112.331 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . 0.455 ' HB2' HD22 ' C' ' 748' ' ' LEU . 2.3 tmm_? -73.97 -33.11 63.74 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -101.56 -17.68 16.27 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-O 121.709 0.766 . . . . 0.0 113.048 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 117.84 169.87 14.91 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 -178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -120.96 -48.56 2.24 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.217 -0.578 . . . . 0.0 110.962 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . . . . . . . . . 25.7 p -106.69 157.98 33.86 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.615 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . 0.402 ' HG3' HD22 ' B' ' 748' ' ' LEU . 51.1 Cg_exo -38.14 96.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.499 1.803 0 C-N-CA 121.913 1.742 . . . . 0.0 111.912 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' C' ' 716' ' ' SER . 28.1 tp -73.41 -20.68 60.67 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . 0.469 ' C ' ' O ' ' C' ' 715' ' ' LEU . 3.2 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.079 0.943 . . . . 0.0 113.04 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.908 0.861 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.1 tpt85 -71.86 -26.85 62.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.563 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.24 -38.92 84.91 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.24 0.543 . . . . 0.0 110.803 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.774 ' O ' HD12 ' C' ' 746' ' ' ILE . 28.0 mtm105 -62.5 -36.39 82.39 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.102 -0.374 . . . . 0.0 111.319 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -58.46 -39.93 81.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.484 . . . . 0.0 110.102 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.59 -49.33 41.49 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.137 0.494 . . . . 0.0 110.798 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -33.83 67.04 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 122.012 -0.43 . . . . 0.0 110.699 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.774 HD12 ' O ' ' C' ' 742' ' ' ARG . 0.7 OUTLIER -59.23 -24.43 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 O-C-N 121.469 -0.769 . . . . 0.0 109.095 178.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -59.37 -21.49 59.94 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.659 HD21 HG13 ' C' ' 705' ' ' VAL . 9.3 tp -55.62 -27.21 48.31 Favored 'General case' 0 C--N 1.348 0.519 0 O-C-N 122.128 -0.358 . . . . 0.0 110.748 178.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . 0.603 HG11 HG11 ' B' ' 782' ' ' VAL . 90.0 t -55.52 -54.08 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.443 ' HB2' HD23 ' B' ' 785' ' ' LEU . 4.3 m-80 -72.42 -25.8 61.62 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.33 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.59 -20.96 40.67 Favored Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.705 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 3.0 m -59.98 -37.95 81.11 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.752 -0.852 . . . . 0.0 109.386 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 14.6 tp -66.7 -51.2 58.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.418 0.628 . . . . 0.0 109.889 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.0 79.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.584 0.707 . . . . 0.0 111.365 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . 0.52 ' C ' HD23 ' C' ' 755' ' ' LEU . 9.1 tt -59.4 -45.45 91.46 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 -178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.25 -35.04 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.64 0.733 . . . . 0.0 109.325 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.34 -30.14 68.1 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.471 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -55.36 -46.61 76.46 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.069 -1.019 . . . . 0.0 109.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -70.69 -45.48 64.93 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.15 -44.0 73.19 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' C' ' 765' ' ' LEU . 10.3 mtm180 -61.39 -49.8 75.46 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . 0.506 ' HB2' ' HD3' ' A' ' 742' ' ' ARG . 1.7 p -66.15 -45.31 81.41 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.542 -0.724 . . . . 0.0 110.8 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.516 ' HA ' ' HG ' ' C' ' 774' ' ' LEU . 0.4 OUTLIER -59.72 -54.38 47.08 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 -178.408 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.86 -48.72 4.81 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' C' ' 761' ' ' ARG . 0.3 OUTLIER 85.97 -78.61 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -177.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -124.59 -86.89 0.63 Allowed 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.483 -0.761 . . . . 0.0 111.337 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 83.4 p -90.13 167.28 12.85 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.56 -0.713 . . . . 0.0 110.225 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.12 -16.18 63.6 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.949 0.404 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -71.12 -44.03 66.42 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -62.69 -30.65 71.55 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.335 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.431 ' C ' HD23 ' C' ' 771' ' ' LEU . 5.3 tt -60.54 -30.49 69.79 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.828 -0.545 . . . . 0.0 109.86 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -57.25 -38.44 73.83 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.167 -0.333 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.29 -39.2 93.9 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.739 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.722 HD22 HD12 ' C' ' 777' ' ' ILE . 0.2 OUTLIER -67.39 -38.17 84.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 121.772 0.796 . . . . 0.0 109.872 178.498 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.724 ' O ' HG22 ' C' ' 778' ' ' VAL . 2.7 mm? -58.42 -36.27 73.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.81 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 24.1 mt -70.56 -29.68 66.2 Favored 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.536 -0.727 . . . . 0.0 110.405 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . 0.722 HD12 HD22 ' C' ' 774' ' ' LEU . 48.2 mt -60.77 -39.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.346 0.415 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.153 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.724 HG22 ' O ' ' C' ' 775' ' ' LEU . 15.0 m -55.5 -43.83 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 119.067 0.849 . . . . 0.0 113.013 -175.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.534 ' O ' HG22 ' C' ' 782' ' ' VAL . 2.4 p -64.28 -48.21 76.56 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.107 -0.995 . . . . 0.0 111.615 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -29.13 68.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.878 HG21 HG22 ' A' ' 746' ' ' ILE . 0.1 OUTLIER -52.98 -36.55 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.6 -175.534 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.534 HG22 ' O ' ' C' ' 779' ' ' THR . 34.5 m -53.41 -37.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 119.11 -1.036 . . . . 0.0 112.092 -177.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.83 -41.91 87.98 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 6.8 tp -70.67 -45.39 65.16 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 -175.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.876 ' HB3' ' HB3' ' A' ' 747' ' ' ARG . 0.5 OUTLIER -88.2 -17.35 31.03 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 120.625 1.557 . . . . 0.0 112.313 -177.427 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . 0.471 ' HA2' ' CZ ' ' A' ' 747' ' ' ARG . . . -52.91 -26.66 27.13 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 177.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.57 131.74 52.58 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.218 -0.578 0 CA-C-O 118.114 -0.946 . . . . 0.0 110.326 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.732 ' N ' HD23 ' C' ' 663' ' ' LEU . 6.8 tp . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 48.2 mt 56.82 90.08 0.04 OUTLIER 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.994 0.902 . . . . 0.0 110.267 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -161.7 -177.34 5.82 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.519 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.486 HD12 ' N ' ' B' ' 660' ' ' LEU . 0.5 OUTLIER -52.31 -40.68 62.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.201 0.525 . . . . 0.0 110.512 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -36.02 65.92 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -178.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -43.54 56.95 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.387 0.613 . . . . 0.0 111.075 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -74.0 -45.83 47.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.406 -179.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.52 -35.86 82.13 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.137 0.494 . . . . 0.0 111.337 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -32.79 68.48 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.319 0.58 . . . . 0.0 110.886 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -24.1 67.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 120.828 0.347 . . . . 0.0 111.487 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -67.95 -19.57 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.003 -0.436 . . . . 0.0 111.688 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -80.88 -17.81 49.36 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.046 0.45 . . . . 0.0 111.508 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 13.9 m95 -61.72 -47.98 82.8 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 t80 63.2 48.01 3.87 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 112.181 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.81 -71.48 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.651 -0.655 . . . . 0.0 112.235 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.657 HG13 HD23 ' A' ' 679' ' ' LEU . 7.2 tp -66.83 -36.81 78.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 O-C-N 121.804 -0.56 . . . . 0.0 112.054 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 9.7 m -51.75 -33.21 33.97 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.922 -0.486 . . . . 0.0 112.037 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -59.38 -49.55 77.37 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.564 -0.71 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -65.78 -44.8 84.7 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.545 0.688 . . . . 0.0 110.583 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.657 HD23 HG13 ' A' ' 675' ' ' ILE . 4.5 mm? -66.64 -37.43 84.81 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -89.91 -1.93 58.08 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -119.96 0.18 10.74 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.431 0.634 . . . . 0.0 110.619 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 685' ' ' PHE . 2.4 tp -61.66 -36.36 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-O 122.115 0.96 . . . . 0.0 110.112 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -59.39 -44.89 92.72 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.78 -33.66 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -59.66 -33.48 71.6 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.804 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.995 HG21 HD12 ' B' ' 686' ' ' ILE . 8.4 mm -60.69 -42.42 91.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.166 0.508 . . . . 0.0 109.9 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -71.82 -39.56 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.4 mt -61.94 -40.69 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.971 -0.455 . . . . 0.0 110.6 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 685' ' ' PHE . 63.0 t -54.49 -39.46 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.14 -36.54 82.56 Favored Glycine 0 CA--C 1.537 1.456 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 6.8 m -65.02 -38.16 89.99 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.816 0.817 . . . . 0.0 109.455 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.05 -46.39 88.36 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.704 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.787 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.0 OUTLIER -68.48 -39.89 81.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.596 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.92 -20.74 54.1 Favored Glycine 0 CA--C 1.54 1.636 0 O-C-N 121.219 -0.925 . . . . 0.0 111.014 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -36.68 82.47 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 122.128 0.965 . . . . 0.0 110.151 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 24.9 mmt180 -56.3 -30.18 62.18 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 1.4 pp -60.5 -36.64 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.542 -1.349 . . . . 0.0 108.893 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.81 ' O ' HG22 ' A' ' 701' ' ' VAL . 1.3 t -67.16 -30.24 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 CA-C-N 115.357 -0.838 . . . . 0.0 108.933 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 0.2 OUTLIER -55.64 -27.92 52.45 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 122.871 0.468 . . . . 0.0 110.343 178.6 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.44 -36.97 69.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.81 HG22 ' O ' ' A' ' 698' ' ' VAL . 11.4 m -59.1 -35.69 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -42.6 91.35 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . 0.434 ' OG ' ' HB1' ' C' ' 700' ' ' ALA . 7.2 m -66.13 -41.16 90.87 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.795 0.807 . . . . 0.0 109.734 179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -40.84 94.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.788 HG23 HD12 ' A' ' 748' ' ' LEU . 0.4 OUTLIER -69.26 -39.61 79.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.448 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 710' ' ' GLN . 1.1 m-80 -62.3 -36.93 83.64 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.102 0.561 . . . . 0.0 111.493 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 712' ' ' TYR . 9.0 ttm180 -62.59 -49.47 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.703 0.763 . . . . 0.0 110.252 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.04 -42.09 31.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.823 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -58.69 -41.37 86.09 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -174.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 706' ' ' ASN . 4.9 pt20 -101.97 -21.87 14.41 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -176.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 711' ' ' GLY . . . . . . . . . . . . . . . 164.82 -128.11 1.74 Allowed Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.681 -0.637 . . . . 0.0 112.459 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 712' ' ' TYR . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 707' ' ' ARG . 0.1 OUTLIER -171.85 -116.84 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -178.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 713' ' ' SER . . . . . 0.436 ' H ' ' HB3' ' A' ' 712' ' ' TYR . 7.3 m -62.83 159.4 45.36 Favored Pre-proline 0 C--N 1.352 0.687 0 O-C-N 120.641 -1.287 . . . . 0.0 109.083 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 714' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_exo -42.88 101.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.358 1.372 . . . . 0.0 111.699 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 715' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 716' ' ' SER . 0.2 OUTLIER -104.39 -20.79 13.62 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.362 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 716' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 715' ' ' LEU . 2.7 t . . . . . 0 CA--C 1.552 1.048 0 CA-C-O 121.997 0.903 . . . . 0.0 111.671 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 739' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.98 0.895 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -26.43 62.48 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.364 -0.835 . . . . 0.0 112.13 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 741' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.5 -9.94 0.57 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 742' ' ' ARG . . . . . . . . . . . . . 10.8 mtm-85 -64.95 -46.36 81.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.349 -0.845 . . . . 0.0 111.208 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 743' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -63.44 -44.69 93.79 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.486 0.66 . . . . 0.0 111.685 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 744' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -71.19 -36.86 72.08 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.711 -0.618 . . . . 0.0 110.56 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 745' ' ' SER . . . . . . . . . . . . . 89.9 p -64.47 -42.21 96.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.759 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 746' ' ' ILE . . . . . 0.558 HD13 ' CD1' ' C' ' 781' ' ' ILE . 0.8 OUTLIER -64.96 -46.95 90.08 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.872 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.188 -178.744 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 747' ' ' ARG . . . . . 0.569 ' HB3' HD22 ' C' ' 785' ' ' LEU 0.32 14.3 ttt180 -70.26 -0.02 7.23 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 116.153 -2.219 . . . . 0.0 111.699 -176.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 748' ' ' LEU . . . . . 0.788 HD12 HG23 ' A' ' 705' ' ' VAL . 2.8 tm? -57.22 -15.5 6.03 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 169.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 749' ' ' VAL . . . . . 0.548 HG12 ' ND2' ' A' ' 750' ' ' ASN 0.308 1.6 t -52.96 -54.37 17.1 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 750' ' ' ASN . . . . . 0.548 ' ND2' HG12 ' A' ' 749' ' ' VAL . 1.6 m-80 -72.86 -26.19 61.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 122.611 1.196 . . . . 0.0 108.458 174.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 751' ' ' GLY . . . . . 0.672 ' HA3' HD22 ' A' ' 748' ' ' LEU . . . -56.64 -19.27 27.05 Favored Glycine 0 C--N 1.341 0.831 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.822 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 11.1 p -57.23 -37.29 72.06 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 753' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.65 -47.69 84.22 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 754' ' ' ALA . . . . . . . . . . . . . . . -62.12 -35.36 78.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.963 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 755' ' ' LEU . . . . . 0.696 ' O ' HD22 ' A' ' 755' ' ' LEU . 0.6 OUTLIER -59.26 -45.07 92.18 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.668 -0.645 . . . . 0.0 110.908 -177.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 756' ' ' ILE . . . . . . . . . . . . . 52.7 mt -61.65 -37.75 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.62 -33.87 73.27 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.087 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 758' ' ' ASP . . . . . 0.814 ' OD1' HD22 ' B' ' 715' ' ' LEU . 17.7 m-20 -55.98 -45.11 79.06 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.823 0.82 . . . . 0.0 109.715 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 759' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.11 -41.38 74.06 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.432 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 760' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.23 -33.94 76.4 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 761' ' ' ARG . . . . . . . . . . . . . 28.1 mtt85 -73.65 -25.8 60.45 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 762' ' ' SER . . . . . . . . . . . . . 60.5 p -77.02 -45.52 26.94 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.624 -0.673 . . . . 0.0 111.217 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 763' ' ' LEU . . . . . 0.695 ' HA ' HD13 ' A' ' 774' ' ' LEU . 10.4 mp -68.39 -54.94 13.84 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.01 -49.3 4.56 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.547 0.689 . . . . 0.0 112.493 -178.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 765' ' ' LEU . . . . . 0.457 HD23 ' CD ' ' B' ' 739' ' ' GLU . 1.1 tm? 88.62 -72.56 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.184 0.993 . . . . 0.0 109.658 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 766' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -118.67 -67.09 1.01 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.773 -0.58 . . . . 0.0 111.157 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 767' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.81 148.15 24.73 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.32 0.581 . . . . 0.0 110.842 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 768' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -62.62 -23.62 67.15 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.993 0.425 . . . . 0.0 110.878 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.868 0.842 . . . . 0.0 109.628 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 770' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -63.57 -29.82 71.02 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.482 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.461 HD22 ' HB3' ' A' ' 763' ' ' LEU . 0.1 OUTLIER -59.77 -45.27 92.77 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -179.393 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 772' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.02 -39.51 90.03 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.617 0.722 . . . . 0.0 109.322 177.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 773' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -64.64 -39.58 93.94 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.7 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 763' ' ' LEU . 0.7 OUTLIER -59.51 -38.74 81.75 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-O 121.109 0.481 . . . . 0.0 111.32 -179.615 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 775' ' ' LEU . . . . . . . . . . . . . 3.2 mt -58.63 -36.99 74.95 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 121.786 -0.571 . . . . 0.0 111.837 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 776' ' ' LEU . . . . . 0.479 HD12 ' N ' ' A' ' 776' ' ' LEU . 6.9 mp -74.04 -44.91 52.64 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.925 -0.484 . . . . 0.0 111.954 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 777' ' ' ILE . . . . . . . . . . . . . 7.5 pt -64.4 -37.31 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.552 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 778' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 774' ' ' LEU . 79.3 t -57.45 -46.74 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.521 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 779' ' ' THR . . . . . . . . . . . . . 37.4 p -63.84 -35.99 82.44 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 122.21 1.005 . . . . 0.0 110.546 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -45.46 74.28 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.349 -0.842 . . . . 0.0 112.9 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.531 HG13 HG21 ' B' ' 746' ' ' ILE . 11.6 pt -69.64 -36.77 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.39 -38.32 79.7 Favored 'Isoleucine or valine' 0 C--N 1.349 0.561 0 O-C-N 121.438 -0.789 . . . . 0.0 109.392 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 783' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -60.89 -43.47 98.44 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-O 121.545 0.688 . . . . 0.0 109.794 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.63 -39.57 84.66 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.59 0.71 . . . . 0.0 110.44 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.522 HD22 ' ND2' ' B' ' 750' ' ' ASN . 0.3 OUTLIER -72.84 -23.51 60.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.58 -179.49 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 786' ' ' GLY . . . . . . . . . . . . . . . -76.55 52.38 3.11 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 14.1 ptt-85 -137.04 124.53 22.11 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 122.111 -0.641 . . . . 0.0 110.536 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 788' ' ' ARG . . . . . . . . . . . . . 30.6 ttm-85 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.944 -1.027 . . . . 0.0 110.45 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.486 ' N ' HD12 ' A' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.571 HD22 ' N ' ' B' ' 661' ' ' LEU . 2.1 mm? 61.82 116.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.649 0.738 . . . . 0.0 110.529 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 177.65 178.45 0.32 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.396 0.617 . . . . 0.0 109.988 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.551 ' CD1' HD13 ' C' ' 660' ' ' LEU . 14.8 tp -50.97 -56.35 12.85 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 122.349 1.071 . . . . 0.0 110.71 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -20.21 65.92 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.793 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -81.15 -44.59 17.66 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.329 0.585 . . . . 0.0 110.25 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -74.91 -46.38 36.3 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.512 0.672 . . . . 0.0 111.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -17.82 63.39 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.559 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 54.4 p -71.58 -31.19 66.68 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.884 -0.51 . . . . 0.0 111.142 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.451 HD22 ' N ' ' B' ' 669' ' ' LEU . 3.9 mm? -59.7 -30.72 68.99 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.09 0.472 . . . . 0.0 110.682 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -59.76 -22.9 62.74 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.06 0.457 . . . . 0.0 111.048 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.92 -24.92 23.47 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.148 0.499 . . . . 0.0 111.453 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.93 -51.61 66.27 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.281 0.562 . . . . 0.0 111.255 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 50.0 t80 57.53 37.59 27.7 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.876 0.846 . . . . 0.0 110.724 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -140.06 -80.5 0.28 Allowed 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.843 -0.535 . . . . 0.0 110.461 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tt -68.2 -35.78 72.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 121.657 -0.652 . . . . 0.0 111.156 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.9 m -50.53 -33.41 21.52 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 121.982 -0.449 . . . . 0.0 111.716 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.72 -49.95 75.43 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.63 ' O ' HG23 ' B' ' 682' ' ' ILE . 0.6 OUTLIER -65.88 -41.58 91.41 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 121.895 0.855 . . . . 0.0 109.591 177.521 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.492 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.2 OUTLIER -62.22 -35.98 80.55 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -177.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 10.8 t90 -106.85 -26.31 11.3 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -79.57 -11.83 59.87 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.483 -0.761 . . . . 0.0 111.898 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.63 HG23 ' O ' ' B' ' 678' ' ' TRP . 5.6 pt -60.66 -36.2 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 O-C-N 121.919 -0.488 . . . . 0.0 110.322 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -52.88 -47.35 67.93 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.29 -0.256 . . . . 0.0 110.682 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.487 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.3 mp -69.66 -36.11 68.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.5 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.2 OUTLIER -59.9 -29.39 68.32 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.967 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.995 HD12 HG21 ' A' ' 686' ' ' ILE . 14.4 mm -61.21 -45.72 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 O-C-N 121.79 -0.569 . . . . 0.0 109.614 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 64.7 mt -65.63 -42.5 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.86 -37.78 68.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 685' ' ' PHE . 49.9 t -59.85 -48.88 86.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.885 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -50.76 -27.33 12.69 Favored Glycine 0 CA--C 1.541 1.693 0 O-C-N 121.691 -0.631 . . . . 0.0 112.054 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 20.1 m -60.65 -42.3 96.7 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 693' ' ' ILE . 0.4 OUTLIER -59.33 -32.75 70.37 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.457 -0.777 . . . . 0.0 112.108 -177.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 692' ' ' LEU . 0.6 OUTLIER -57.86 -47.83 85.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 O-C-N 121.704 -0.622 . . . . 0.0 109.618 -178.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.433 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -62.36 -32.83 84.25 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.548 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.7 tt -53.91 -36.43 62.72 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.287 1.042 . . . . 0.0 110.031 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.748 ' HG3' HD11 ' A' ' 693' ' ' ILE . 25.8 mmt180 -55.02 -27.63 45.88 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 124.104 0.961 . . . . 0.0 112.505 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.735 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.0 OUTLIER -58.33 -36.1 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 O-C-N 120.832 -1.168 . . . . 0.0 108.844 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.548 HG12 ' O ' ' B' ' 695' ' ' LEU . 2.7 p -64.51 -30.81 51.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 O-C-N 121.422 -0.799 . . . . 0.0 109.967 177.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' B' ' 696' ' ' ARG . 2.9 m-85 -56.65 -31.01 63.97 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.833 -0.542 . . . . 0.0 109.681 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -58.93 -37.52 76.89 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -41.57 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 176.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 4.9 tp -58.39 -39.12 78.8 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.825 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 50.2 m -64.07 -36.62 84.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.436 0.636 . . . . 0.0 109.813 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.464 HD11 ' O ' ' C' ' 712' ' ' TYR . 0.3 OUTLIER -62.23 -43.28 99.19 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.28 1.038 . . . . 0.0 109.136 178.22 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . 0.718 HG22 HD23 ' B' ' 748' ' ' LEU . 93.8 t -69.82 -45.47 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.717 179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . 0.485 ' O ' ' HG2' ' B' ' 710' ' ' GLN . 7.6 m-20 -62.92 -39.64 95.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.404 -179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -48.59 60.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 0.0 111.401 -177.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.5 HG21 ' HA ' ' C' ' 713' ' ' SER . 0.4 OUTLIER -76.66 -42.55 34.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -176.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.53 -45.24 94.57 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . 0.658 ' O ' HD11 ' B' ' 715' ' ' LEU . 5.5 pt20 -104.84 -24.54 12.87 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 711' ' ' GLY . . . . . . . . . . . . . . . 144.5 160.18 8.39 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 712' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -100.79 -70.64 0.73 Allowed 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.731 -0.864 . . . . 0.0 112.795 -178.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 713' ' ' SER . . . . . 0.411 ' O ' ' C ' ' B' ' 714' ' ' PRO . 1.6 m -63.24 159.46 48.62 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-O 118.256 -0.878 . . . . 0.0 109.717 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 714' ' ' PRO . . . . . 0.411 ' C ' ' O ' ' B' ' 713' ' ' SER . 3.7 Cg_exo -28.44 108.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 122.651 2.234 . . . . 0.0 112.614 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 715' ' ' LEU . . . . . 0.814 HD22 ' OD1' ' A' ' 758' ' ' ASP . 1.6 tt -75.94 -11.91 60.05 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 716' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 122.159 0.98 . . . . 0.0 111.942 -178.723 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 739' ' ' GLU . . . . . 0.457 ' CD ' HD23 ' A' ' 765' ' ' LEU . 31.3 tp10 . . . . . 0 N--CA 1.464 0.249 0 CA-C-O 121.798 0.809 . . . . 0.0 111.405 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -30.16 65.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.266 -178.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 741' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.0 -8.39 2.29 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 742' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -35.66 80.77 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.538 -0.726 . . . . 0.0 111.13 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 743' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -58.74 -42.39 88.67 Favored 'General case' 0 C--N 1.344 0.33 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 744' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -71.43 -35.56 70.98 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.834 177.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 11.2 m -57.1 -37.73 72.35 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.065 -0.397 . . . . 0.0 110.227 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 746' ' ' ILE . . . . . 0.531 HG21 HG13 ' A' ' 781' ' ' ILE . 1.4 mp -55.68 -17.69 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.564 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 747' ' ' ARG . . . . . 0.496 ' HG2' HD21 ' A' ' 785' ' ' LEU . 0.2 OUTLIER -59.52 -29.66 68.04 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.149 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 748' ' ' LEU . . . . . 0.718 HD23 HG22 ' B' ' 705' ' ' VAL . 12.7 tp -55.7 -18.54 8.32 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.082 0.468 . . . . 0.0 110.05 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 749' ' ' VAL . . . . . . . . . . . . . 42.5 t -55.69 -53.34 38.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.658 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 750' ' ' ASN . . . . . 0.522 ' ND2' HD22 ' A' ' 785' ' ' LEU . 4.2 m-80 -71.96 -18.87 61.96 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.795 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 751' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' B' ' 748' ' ' LEU . . . -57.16 -20.46 35.54 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.053 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 752' ' ' SER . . . . . . . . . . . . . 67.5 p -58.6 -38.14 77.34 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.849 -0.795 . . . . 0.0 109.408 179.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 753' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.84 -50.73 63.55 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.461 0.648 . . . . 0.0 109.62 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 754' ' ' ALA . . . . . . . . . . . . . . . -64.84 -35.53 81.43 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 755' ' ' LEU . . . . . . . . . . . . . 8.3 tt -59.84 -45.51 92.2 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.794 -0.567 . . . . 0.0 110.756 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 756' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.29 -37.78 80.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.652 0.739 . . . . 0.0 109.178 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.08 -30.31 68.6 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.342 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 758' ' ' ASP . . . . . 0.406 ' OD2' HD23 ' C' ' 715' ' ' LEU . 70.7 m-20 -55.58 -49.79 71.8 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.844 -1.16 . . . . 0.0 109.281 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 759' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.67 -45.89 60.58 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 121.42 0.628 . . . . 0.0 112.45 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 760' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 -46.72 65.37 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 761' ' ' ARG . . . . . . . . . . . . . 8.9 ttm-85 -64.26 -49.94 69.91 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -177.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 762' ' ' SER . . . . . . . . . . . . . 3.0 m -62.27 -43.56 98.55 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.999 -0.438 . . . . 0.0 111.684 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 763' ' ' LEU . . . . . 0.589 ' O ' HD13 ' B' ' 774' ' ' LEU . 0.3 OUTLIER -60.89 -53.84 52.34 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 60.2 p -98.06 -49.24 4.83 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.396 0.617 . . . . 0.0 112.348 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 765' ' ' LEU . . . . . . . . . . . . . 24.6 tp 69.15 102.92 0.06 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.867 0.842 . . . . 0.0 110.333 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 766' ' ' PHE . . . . . . . . . . . . . 42.6 t80 64.6 -77.93 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.925 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 767' ' ' SER . . . . . . . . . . . . . 20.0 m -95.73 151.82 19.02 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.597 -0.689 . . . . 0.0 111.356 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 768' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.26 -30.88 43.28 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.864 0.364 . . . . 0.0 110.5 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 769' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -53.34 -40.44 64.9 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.92 0.867 . . . . 0.0 109.357 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 770' ' ' ARG . . . . . . . . . . . . . 1.1 tpt85 -58.24 -29.49 65.79 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.578 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 771' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.95 -34.96 72.38 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 772' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -64.14 -35.03 79.46 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 773' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -66.98 -46.95 73.06 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 774' ' ' LEU . . . . . 0.628 ' HG ' HD11 ' B' ' 777' ' ' ILE . 1.5 tt -63.25 -37.98 89.37 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.953 0.882 . . . . 0.0 110.264 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 775' ' ' LEU . . . . . 0.566 HD13 ' O ' ' B' ' 775' ' ' LEU . 0.3 OUTLIER -60.97 -37.06 81.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.836 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 776' ' ' LEU . . . . . 0.531 ' O ' HG22 ' B' ' 779' ' ' THR . 59.0 mt -71.48 -44.86 63.95 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.931 -0.481 . . . . 0.0 111.688 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 777' ' ' ILE . . . . . 0.628 HD11 ' HG ' ' B' ' 774' ' ' LEU . 1.7 pp -64.5 -36.97 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.734 -0.604 . . . . 0.0 109.49 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 778' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' B' ' 781' ' ' ILE . 51.8 t -57.31 -46.31 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 O-C-N 121.678 -0.639 . . . . 0.0 111.028 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 779' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 782' ' ' VAL . 5.8 t -63.5 -35.57 80.88 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.557 -0.714 . . . . 0.0 112.158 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -31.5 71.81 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.68 -0.638 . . . . 0.0 111.308 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 781' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' B' ' 778' ' ' VAL . 79.8 mt -60.42 -42.69 91.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.081 -0.387 . . . . 0.0 111.585 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 782' ' ' VAL . . . . . 0.601 HG22 ' O ' ' B' ' 779' ' ' THR . 6.7 m -54.93 -38.81 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.334 -0.854 . . . . 0.0 110.061 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 783' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -62.32 -45.56 92.68 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.596 0.713 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 784' ' ' LEU . . . . . . . . . . . . . 17.5 tp -66.12 -43.97 85.6 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.293 0.568 . . . . 0.0 111.078 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 785' ' ' LEU . . . . . 0.511 HD23 ' ND2' ' C' ' 750' ' ' ASN . 4.2 tp -77.12 -16.47 59.16 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.074 0.464 . . . . 0.0 111.273 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 786' ' ' GLY . . . . . . . . . . . . . . . -46.3 -48.11 15.91 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 787' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.88 106.99 19.38 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 788' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.524 -179.467 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.551 HD13 ' CD1' ' B' ' 663' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 121.496 0.665 . . . . 0.0 109.286 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.526 ' N ' HD12 ' C' ' 661' ' ' LEU . 6.8 mp 60.68 120.81 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.621 0.725 . . . . 0.0 111.555 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.55 169.21 3.13 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.426 0.631 . . . . 0.0 110.059 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.732 HD23 ' N ' ' A' ' 660' ' ' LEU . 0.3 OUTLIER -57.08 -52.07 66.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.763 0.792 . . . . 0.0 109.679 179.357 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.624 ' N ' HD13 ' C' ' 663' ' ' LEU . 1.8 t70 -72.71 -17.15 61.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.853 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -81.07 -44.26 18.27 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.027 0.441 . . . . 0.0 111.189 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -63.95 -46.28 85.41 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.45 0.643 . . . . 0.0 110.284 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.48 -26.53 68.76 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.533 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 4.7 t -63.75 -37.97 89.37 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.047 0.451 . . . . 0.0 111.723 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.18 -34.78 74.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.869 0.366 . . . . 0.0 111.629 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -59.67 -21.96 61.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.036 0.446 . . . . 0.0 111.285 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -79.61 -24.54 41.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.173 0.511 . . . . 0.0 111.26 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.8 m95 -58.77 -37.63 76.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.507 0.67 . . . . 0.0 110.352 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 59.09 27.48 16.45 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.008 178.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.71 -68.81 0.1 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.548 -0.72 . . . . 0.0 112.227 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.703 HD13 ' O ' ' C' ' 675' ' ' ILE . 0.2 OUTLIER -58.05 -37.93 64.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.517 0.675 . . . . 0.0 111.083 -178.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 1.3 m -52.54 -33.84 47.36 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.958 -0.463 . . . . 0.0 111.149 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -62.95 -50.03 72.42 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.037 0.446 . . . . 0.0 110.343 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.701 ' O ' HG23 ' C' ' 682' ' ' ILE . 0.4 OUTLIER -65.69 -44.2 86.92 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.284 0.564 . . . . 0.0 109.801 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.559 HD12 HD12 ' C' ' 675' ' ' ILE . 0.5 OUTLIER -64.55 -35.76 82.01 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.06 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -95.51 -33.52 12.4 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -75.36 -16.37 60.39 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.788 -0.57 . . . . 0.0 111.876 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.701 HG23 ' O ' ' C' ' 678' ' ' TRP . 2.0 pp -60.54 -36.77 72.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.877 -0.514 . . . . 0.0 110.304 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.556 ' N ' HD12 ' C' ' 682' ' ' ILE . 9.5 ttt-85 -57.04 -47.34 81.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.216 0.531 . . . . 0.0 110.005 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.427 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -66.81 -35.73 75.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.406 ' O ' HG23 ' C' ' 689' ' ' VAL . 0.3 OUTLIER -59.81 -32.03 70.26 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.867 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.942 HG21 HD12 ' A' ' 686' ' ' ILE . 9.6 mm -60.86 -49.51 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.327 0.584 . . . . 0.0 109.95 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 78.4 mt -65.27 -36.94 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.8 -37.94 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.406 HG23 ' O ' ' C' ' 685' ' ' PHE . 73.5 t -55.73 -39.99 58.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.18 -40.32 91.44 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 9.8 m -63.26 -39.41 94.53 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 122.167 0.984 . . . . 0.0 109.817 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -46.15 89.2 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.318 -177.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.85 -42.12 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . 0.622 ' O ' HG22 ' C' ' 697' ' ' ILE . . . -60.51 -32.28 77.4 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.66 ' O ' HG12 ' C' ' 698' ' ' VAL . 2.3 tt -58.22 -38.41 76.74 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.997 0.903 . . . . 0.0 109.645 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -55.95 -28.13 55.6 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.622 HG22 ' O ' ' C' ' 694' ' ' GLY . 19.8 tt -58.06 -36.35 56.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 O-C-N 120.924 -1.11 . . . . 0.0 111.141 -175.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.66 HG12 ' O ' ' C' ' 695' ' ' LEU . 13.9 p -54.86 -29.51 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 121.402 -0.812 . . . . 0.0 109.375 176.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.43 -31.58 64.06 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.171 -0.956 . . . . 0.0 109.619 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . 0.434 ' HB1' ' OG ' ' A' ' 703' ' ' SER . . . -60.48 -43.01 97.41 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' C' ' 698' ' ' VAL . 52.7 t -68.33 -36.24 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.698 177.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.82 -37.03 82.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.366 0.667 . . . . 0.0 109.773 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.6 m -62.19 -36.45 81.95 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.219 0.533 . . . . 0.0 110.518 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -41.35 97.91 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 122.153 0.977 . . . . 0.0 108.708 178.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . 0.533 ' HA ' HD11 ' C' ' 748' ' ' LEU . 60.5 t -65.58 -44.53 93.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-O 122.176 0.988 . . . . 0.0 108.952 178.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.35 -35.88 80.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.333 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -49.69 75.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 121.685 -0.634 . . . . 0.0 110.532 -178.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -44.67 32.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.435 0.636 . . . . 0.0 111.766 -178.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -73.36 -39.85 64.84 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.377 -178.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -102.67 -18.89 15.0 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 711' ' ' GLY . . . . . . . . . . . . . . . 102.31 171.11 27.08 Favored Glycine 0 CA--C 1.536 1.348 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 712' ' ' TYR . . . . . 0.464 ' O ' HD11 ' B' ' 704' ' ' LEU . 15.1 p90 -119.13 -54.29 2.22 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.681 -0.893 . . . . 0.0 112.297 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 713' ' ' SER . . . . . 0.5 ' HA ' HG21 ' B' ' 708' ' ' VAL . 87.6 p -94.44 159.42 33.84 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-O 118.752 -0.642 . . . . 0.0 110.423 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 714' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -39.55 103.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.668 1.579 . . . . 0.0 111.749 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 715' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' C' ' 716' ' ' SER . 27.7 tp -85.81 -19.89 30.0 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 716' ' ' SER . . . . . 0.479 ' C ' ' O ' ' C' ' 715' ' ' LEU . 35.5 t . . . . . 0 N--CA 1.5 2.052 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 739' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.58 0.705 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 740' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -61.7 -33.26 73.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.346 0.593 . . . . 0.0 111.088 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 741' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -58.32 -38.23 76.7 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.113 0.482 . . . . 0.0 110.95 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 742' ' ' ARG . . . . . 0.464 ' HD2' HD11 ' B' ' 774' ' ' LEU . 26.2 mtm105 -63.24 -42.67 99.23 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 122.175 -0.328 . . . . 0.0 111.153 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 743' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -58.03 -38.42 76.2 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.41 0.624 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 744' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -71.1 -42.54 69.17 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 121.375 0.607 . . . . 0.0 109.573 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 745' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.28 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.123 -0.361 . . . . 0.0 111.051 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 746' ' ' ILE . . . . . 0.416 HG21 ' HB ' ' B' ' 781' ' ' ILE . 1.5 mp -57.58 -21.0 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 120.039 -0.664 . . . . 0.0 109.717 178.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 747' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -59.67 -28.13 66.99 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.359 -0.838 . . . . 0.0 109.074 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 748' ' ' LEU . . . . . 0.591 ' O ' HD23 ' C' ' 748' ' ' LEU . 1.2 tt -55.98 -24.49 39.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 749' ' ' VAL . . . . . . . . . . . . . 53.8 t -55.59 -54.6 24.06 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 750' ' ' ASN . . . . . 0.511 ' ND2' HD23 ' B' ' 785' ' ' LEU . 4.3 m-80 -72.9 -26.76 61.54 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.094 0.95 . . . . 0.0 109.233 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 751' ' ' GLY . . . . . . . . . . . . . . . -57.32 -20.83 38.12 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.241 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 752' ' ' SER . . . . . . . . . . . . . 74.7 m -60.51 -38.02 83.0 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.919 -0.754 . . . . 0.0 109.429 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 753' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.61 -50.1 54.12 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.352 0.596 . . . . 0.0 110.159 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 754' ' ' ALA . . . . . . . . . . . . . . . -67.17 -35.71 80.24 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 755' ' ' LEU . . . . . . . . . . . . . 9.9 tt -60.38 -45.46 93.46 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.311 0.577 . . . . 0.0 110.383 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 756' ' ' ILE . . . . . . . . . . . . . 54.5 mt -65.62 -36.91 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.894 0.854 . . . . 0.0 108.717 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 757' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -69.22 -30.6 68.79 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.933 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 758' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -55.56 -46.01 77.22 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.571 -0.706 . . . . 0.0 110.244 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 759' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.25 -41.9 72.91 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.283 0.563 . . . . 0.0 110.987 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 760' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -33.34 75.5 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 761' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -81.95 -38.93 24.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 762' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -44.52 61.89 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.246 -0.909 . . . . 0.0 109.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 763' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' C' ' 771' ' ' LEU . 5.2 tt -64.23 -53.66 45.63 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.502 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 764' ' ' SER . . . . . 0.528 ' HB2' HD12 ' C' ' 771' ' ' LEU . 46.6 t -97.81 -49.24 4.89 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.529 -0.732 . . . . 0.0 112.496 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 765' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.17 98.53 0.07 Allowed 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 122.036 0.922 . . . . 0.0 110.914 -178.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 766' ' ' PHE . . . . . . . . . . . . . 62.9 t80 48.88 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.417 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 767' ' ' SER . . . . . . . . . . . . . 20.3 t -73.9 154.01 39.59 Favored 'General case' 0 C--N 1.346 0.418 0 O-C-N 121.325 -0.859 . . . . 0.0 110.598 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 768' ' ' TYR . . . . . 0.469 ' CE2' HD13 ' C' ' 771' ' ' LEU . 0.3 OUTLIER -76.24 -19.46 58.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.93 0.395 . . . . 0.0 110.761 179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -43.72 88.37 Favored 'General case' 0 C--N 1.345 0.375 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 770' ' ' ARG . . . . . . . . . . . . . 27.5 mmt-85 -58.73 -30.77 67.72 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.487 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 771' ' ' LEU . . . . . 0.744 ' O ' HD23 ' C' ' 771' ' ' LEU . 4.4 tt -60.67 -32.6 71.79 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.08 0.467 . . . . 0.0 109.842 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 772' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.31 -37.78 70.39 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 773' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -63.98 -34.72 78.64 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 774' ' ' LEU . . . . . 0.472 HD13 ' O ' ' C' ' 774' ' ' LEU . 0.2 OUTLIER -58.64 -38.68 78.62 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-O 121.074 0.464 . . . . 0.0 110.355 179.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 775' ' ' LEU . . . . . 0.426 ' O ' HG22 ' C' ' 778' ' ' VAL . 4.1 mm? -59.24 -43.25 92.39 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.564 0.697 . . . . 0.0 110.623 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 776' ' ' LEU . . . . . . . . . . . . . 50.3 mt -74.34 -34.7 63.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.603 0.716 . . . . 0.0 110.182 178.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 777' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.03 -43.15 95.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.523 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 778' ' ' VAL . . . . . 0.527 HG12 HG12 ' A' ' 746' ' ' ILE . 34.6 m -64.93 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.191 -179.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 779' ' ' THR . . . . . 0.773 ' O ' HG22 ' C' ' 782' ' ' VAL . 0.2 OUTLIER -63.79 -48.11 78.21 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.843 -0.535 . . . . 0.0 111.784 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 780' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -31.41 71.53 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.143 0.497 . . . . 0.0 111.769 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 781' ' ' ILE . . . . . 0.558 ' CD1' HD13 ' A' ' 746' ' ' ILE . 21.2 mt -57.85 -36.88 57.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 782' ' ' VAL . . . . . 0.773 HG22 ' O ' ' C' ' 779' ' ' THR . 33.9 m -53.2 -37.77 28.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.518 0 CA-C-N 119.35 0.977 . . . . 0.0 110.94 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 783' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.6 -41.59 90.67 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.855 -0.528 . . . . 0.0 112.074 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 784' ' ' LEU . . . . . . . . . . . . . 16.3 tp -70.15 -44.59 68.51 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -176.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 785' ' ' LEU . . . . . 0.569 HD22 ' HB3' ' A' ' 747' ' ' ARG . 3.4 tp -71.89 -32.84 67.83 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.969 -1.082 . . . . 0.0 110.389 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 786' ' ' GLY . . . . . . . . . . . . . . . -40.92 -48.06 4.17 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 116.442 -0.345 . . . . 0.0 112.451 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 787' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.35 100.07 10.5 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.808 0.813 . . . . 0.0 111.181 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 788' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.365 179.945 . . . . . . . . 0 0 . 1 stop_ save_